AC1NJXE1 structure

AC1NJXE1

N-[3-[4-(dimethylamino)phenyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-methylpropanamide

Also Known As: N-[(2E)-3-[4-(dimethylamino)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide|(Z)-N-(3-(4-(dimethylamino)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide|4-[4-(dimethylamino)phenyl]-5-(3-methyl-2-oxo-1-azabutylidene)-1,3,4,6,3a,6a-h exahydro-2,6-dithia-4-azapentalene-2,2-dione|N-[3-(4-dimethylaminophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-methylpropanamide

CAS: 892632-97-2
Molecular Formula C17H23N3O3S2
Molecular Weight 381.11807 g/mol
LogP 2.01
Topological Polar Surface Area 70.05 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 381.11807
Monoisotopic Mass 381.11807
Heavy Atoms 25
Complexity 800.9319

Chemical Identifiers

CAS Number 892632-97-2
SMILES CC(C)C(=O)N=C1N(C2CS(=O)(=O)CC2S1)C3=CC=C(C=C3)N(C)C

Product Overview

AC1NJXE1 (CAS 892632-97-2), with molecular formula C17H23N3O3S2 and molecular weight 381.11807 g/mol. IUPAC: N-[3-[4-(dimethylamino)phenyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-methylpropanamide.

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