4-oxidanylidene-N-[1-(phenylcarbamoyl)piperidin-4-yl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-[1-(phenylcarbamoyl)piperidin-4-yl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-[1-(phenylcarbamoyl)-4-piperidyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[1-[anilino(oxo)methyl]-4-piperidinyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-[1-(phenylcarbamoyl)piperidin-4-yl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-[1-(phenylcarbamoyl)-4-piperidyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S/c27-20-10-13-30-19-7-6-15(14-18(19)25-20)21(28)23-17-8-11-26(12-9-17)22(29)24-16-4-2-1-3-5-16/h1-7,14,17H,8-13H2,(H,23,28)(H,24,29)(H,25,27)