4-oxidanylidene-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(N=C2)CC3=CC=CC=C3)NC(=O)C4=CC5=C(C=C4)SCCC(=O)N5

Isomeric SMILES

C1CC(C2=C(C1)N(N=C2)CC3=CC=CC=C3)NC(=O)C4=CC5=C(C=C4)SCCC(=O)N5

InChI

InChI=1S/C24H24N4O2S/c29-23-11-12-31-22-10-9-17(13-20(22)26-23)24(30)27-19-7-4-8-21-18(19)14-25-28(21)15-16-5-2-1-3-6-16/h1-3,5-6,9-10,13-14,19H,4,7-8,11-12,15H2,(H,26,29)(H,27,30)