4-oxidanylidene-N-(4-phenylmethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-(4-phenylmethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(4-benzyloxyphenyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-(4-phenylmethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-(4-phenylmethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-(4-benzoxyphenyl)-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)NC1=O

InChI

InChI=1S/C23H20N2O3S/c26-22-12-13-29-21-11-6-17(14-20(21)25-22)23(27)24-18-7-9-19(10-8-18)28-15-16-4-2-1-3-5-16/h1-11,14H,12-13,15H2,(H,24,27)(H,25,26)