N-[2-(3,4-dimethoxyphenyl)ethyl]-1-oxidanylidene-isothiochromene-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-oxidanylidene-isothiochromene-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-oxo-isothiochromene-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-oxo-2-benzothiopyran-3-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-oxoisothiochromene-3-carboxamide Traditional Name: N-homoveratryl-1-keto-isothiochromene-3-carboxamide Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC3=CC=CC=C3C(=O)S2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC3=CC=CC=C3C(=O)S2)OC

InChI

InChI=1S/C20H19NO4S/c1-24-16-8-7-13(11-17(16)25-2)9-10-21-19(22)18-12-14-5-3-4-6-15(14)20(23)26-18/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)