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

Systemtic Name: 4-oxidanylidene-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-[1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C21H21F3N4O2S MolecularWeight: 450.47725

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H21F3N4O2S/c22-21(23,24)14-2-4-18(25-12-14)28-8-5-15(6-9-28)26-20(30)13-1-3-17-16(11-13)27-19(29)7-10-31-17/h1-4,11-12,15H,5-10H2,(H,26,30)(H,27,29)