(E)-3-(3,4-dimethoxyphenyl)-N-[(3-piperidin-1-ylcarbonylphenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(3-piperidin-1-ylcarbonylphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[3-(piperidine-1-carbonyl)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[3-[oxo(1-piperidinyl)methyl]anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[3-(piperidine-1-carbonyl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[3-(piperidine-1-carbonyl)phenyl]thiocarbamoyl]acrylamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCCCC3)OC

InChI

InChI=1S/C24H27N3O4S/c1-30-20-11-9-17(15-21(20)31-2)10-12-22(28)26-24(32)25-19-8-6-7-18(16-19)23(29)27-13-4-3-5-14-27/h6-12,15-16H,3-5,13-14H2,1-2H3,(H2,25,26,28,32)/b12-10+