7-[3-(trifluoromethyl)piperidin-1-yl]carbonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 7-[3-(trifluoromethyl)piperidin-1-yl]carbonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 7-[3-(trifluoromethyl)piperidine-1-carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 7-[oxo-[3-(trifluoromethyl)-1-piperidinyl]methyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 7-[3-(trifluoromethyl)piperidine-1-carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 7-[3-(trifluoromethyl)piperidine-1-carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C16H17F3N2O2S MolecularWeight: 358.37859

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C(F)(F)F

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C(F)(F)F

InChI

InChI=1S/C16H17F3N2O2S/c17-16(18,19)11-2-1-6-21(9-11)15(23)10-3-4-13-12(8-10)20-14(22)5-7-24-13/h3-4,8,11H,1-2,5-7,9H2,(H,20,22)