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

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)butyl]-4-oxidanylidene-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)butyl]-4-oxo-N-phenyl-thiochromane-3-carboxamide CAS Name: N-[4-(3,4-dimethoxyphenyl)butyl]-4-oxo-N-phenyl-2,3-dihydro-1-benzothiopyran-3-carboxamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)butyl]-4-oxo-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)butyl]-4-keto-N-phenyl-thiochroman-3-carboxamide Formula: C28H29NO4S MolecularWeight: 475.59916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29NO4S/c1-32-24-16-15-20(18-25(24)33-2)10-8-9-17-29(21-11-4-3-5-12-21)28(31)23-19-34-26-14-7-6-13-22(26)27(23)30/h3-7,11-16,18,23H,8-10,17,19H2,1-2H3