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

Systemtic Name: 4-oxidanylidene-N-(4-phenoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-(4-phenoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-(4-phenoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-(4-phenoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-(4-phenoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C22H18N2O3S MolecularWeight: 390.45492

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)NC1=O

InChI

InChI=1S/C22H18N2O3S/c25-21-12-13-28-20-11-6-15(14-19(20)24-21)22(26)23-16-7-9-18(10-8-16)27-17-4-2-1-3-5-17/h1-11,14H,12-13H2,(H,23,26)(H,24,25)