3-(4-chlorophenyl)sulfanyl-N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-[(E)-(3,4-dimethoxyphenyl)methyleneamino]propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-[(E)-veratrylideneamino]propionamide Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)CCSC2=CC=C(C=C2)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)CCSC2=CC=C(C=C2)Cl)OC

InChI

InChI=1S/C18H19ClN2O3S/c1-23-16-8-3-13(11-17(16)24-2)12-20-21-18(22)9-10-25-15-6-4-14(19)5-7-15/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)/b20-12+