N-[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-N-phenyl-2,3-dihydrothiochromene-3-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-oxo-N-phenyl-thiochromane-3-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-oxo-N-phenyl-2,3-dihydro-1-benzothiopyran-3-carboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-oxo-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Traditional Name: 4-keto-N-phenyl-N-veratryl-thiochroman-3-carboxamide Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(C2=CC=CC=C2)C(=O)C3CSC4=CC=CC=C4C3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(C2=CC=CC=C2)C(=O)C3CSC4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C25H23NO4S/c1-29-21-13-12-17(14-22(21)30-2)15-26(18-8-4-3-5-9-18)25(28)20-16-31-23-11-7-6-10-19(23)24(20)27/h3-14,20H,15-16H2,1-2H3