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

Systemtic Name: N-[3-(3,4-dimethoxyphenyl)propyl]-4-oxidanylidene-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Openeye Name: N-[3-(3,4-dimethoxyphenyl)propyl]-4-oxo-N-phenyl-thiochromane-3-carboxamide CAS Name: N-[3-(3,4-dimethoxyphenyl)propyl]-4-oxo-N-phenyl-2,3-dihydro-1-benzothiopyran-3-carboxamide IUPAC Name: N-[3-(3,4-dimethoxyphenyl)propyl]-4-oxo-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Traditional Name: N-[3-(3,4-dimethoxyphenyl)propyl]-4-keto-N-phenyl-thiochroman-3-carboxamide Formula: C27H27NO4S MolecularWeight: 461.57258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27NO4S/c1-31-23-15-14-19(17-24(23)32-2)9-8-16-28(20-10-4-3-5-11-20)27(30)22-18-33-25-13-7-6-12-21(25)26(22)29/h3-7,10-15,17,22H,8-9,16,18H2,1-2H3