MLS000538755 structure

MLS000538755

3-methyl-N-[4-[[(E)-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ylidene)amino]carbamoyl]phenyl]benzamide

Also Known As: AN-329/40614317|N-(4-{[2-(5-isopropenyl-2-methylcyclohex-2-en-1-ylidene)hydrazino]carbonyl}phenyl)-3-methylbenzamide|3-methyl-N-[4-({(2E)-2-[2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ylidene]hydrazinyl}carbonyl)phenyl]benzamide|3-METHYL-N-(4-{N'-[(1E)-2-METHYL-5-(PROP-1-EN-2-YL)CYCLOHEX-2-EN-1-YLIDENE]HYDRAZINECARBONYL}PHENYL)BENZAMIDE|3-methyl-N-[4-[[(2-methyl-5-prop-1-en-2-yl-cyclohex-2-en-1-ylidene)amino]carbamoyl]phenyl]benzamide|3-methyl-N-[4-[[(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ylidene)amino]carbamoyl]phenyl]benzamide|3-methyl-N-[4-[[(E)-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ylidene)amino]carbamoyl]phenyl]benzamide|3-methyl-N-[4-[[2-[2-methyl-5-(1-methylethenyl)-1-cyclohex-2-enylidene]hydrazinyl]-oxomethyl]phenyl]benzamide|N-(4-{[2-(5-isopropenyl-2-methyl-2-cyclohexen-1-ylidene)hydrazino]carbonyl}phenyl)-3-methylbenzamide|N-[4-[[(5-isopropenyl-2-methyl-cyclohex-2-en-1-ylidene)amino]carbamoyl]phenyl]-3-methyl-benzamide

CAS: 355437-28-4
Molecular Formula C25H27N3O2
Molecular Weight 401.21033 g/mol
LogP 5.26552
Topological Polar Surface Area 70.56 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
Rotatable Bonds 5
Exact Mass 401.21033
Monoisotopic Mass 401.21033
Heavy Atoms 30
Complexity 1032.6141

Chemical Identifiers

CAS Number 355437-28-4
SMILES CC\1=CCC(C/C1=N\NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC(=C3)C)C(=C)C

Product Overview

MLS000538755 (CAS 355437-28-4), with molecular formula C25H27N3O2 and molecular weight 401.21033 g/mol. IUPAC: 3-methyl-N-[4-[[(E)-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ylidene)amino]carbamoyl]phenyl]benzamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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