3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]methanone Formula: C21H22F3N3OS MolecularWeight: 421.47909

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H22F3N3OS/c22-21(23,24)16-6-7-19(25-14-16)26-11-8-15(9-12-26)20(28)27-10-3-13-29-18-5-2-1-4-17(18)27/h1-2,4-7,14-15H,3,8-13H2