N-[(2-methoxyphenyl)methyl]-4-oxidanylidene-N-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-4-oxidanylidene-N-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[(2-methoxyphenyl)methyl]-4-oxo-N-(2-thienylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[(2-methoxyphenyl)methyl]-4-oxo-N-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-4-oxo-N-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-o-anisyl-N-(2-thenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C23H22N2O3S2 MolecularWeight: 438.56238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CC2=CC=CS2)C(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

COC1=CC=CC=C1CN(CC2=CC=CS2)C(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C23H22N2O3S2/c1-28-20-7-3-2-5-17(20)14-25(15-18-6-4-11-29-18)23(27)16-8-9-21-19(13-16)24-22(26)10-12-30-21/h2-9,11,13H,10,12,14-15H2,1H3,(H,24,26)