AC1MSSSR structure

AC1MSSSR

2-chloro-N-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide

Also Known As: Oprea1_518155|F0417-0359|2-chloro-N-(5-((2-((4-methoxyphenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|2-CHLORO-N-[5-({[(4-METHOXYPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,3,4-THIADIAZOL-2-YL]BENZAMIDE|2-chloro-N-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide|2-chloro-N-[5-[(4-methoxyphenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide

CAS: 392293-69-5
Molecular Formula C18H15ClN4O3S2
Molecular Weight 434.0274 g/mol
LogP 4.1832
Topological Polar Surface Area 93.21 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 434.0274
Monoisotopic Mass 434.0274
Heavy Atoms 28
Complexity 978.97186

Chemical Identifiers

CAS Number 392293-69-5
SMILES COC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=CC=C3Cl

Product Overview

AC1MSSSR (CAS 392293-69-5), with molecular formula C18H15ClN4O3S2 and molecular weight 434.0274 g/mol. IUPAC: 2-chloro-N-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]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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