N-[(E)-(3,4-diethoxyphenyl)methylideneamino]-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-[(E)-(3,4-diethoxyphenyl)methylideneamino]-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-[(E)-(3,4-diethoxyphenyl)methyleneamino]propanamide CAS Name: N-[(E)-(3,4-diethoxyphenyl)methylideneamino]-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-[(E)-(3,4-diethoxyphenyl)methylideneamino]propanamide Traditional Name: 2-(benzylthio)-N-[(E)-(3,4-diethoxybenzylidene)amino]propionamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=NNC(=O)C(C)SCC2=CC=CC=C2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=N/NC(=O)C(C)SCC2=CC=CC=C2)OCC

InChI

InChI=1S/C21H26N2O3S/c1-4-25-19-12-11-18(13-20(19)26-5-2)14-22-23-21(24)16(3)27-15-17-9-7-6-8-10-17/h6-14,16H,4-5,15H2,1-3H3,(H,23,24)/b22-14+