3-oxidanyl-5-(2-piperidin-1-ylethyl)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 3-oxidanyl-5-(2-piperidin-1-ylethyl)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 3-hydroxy-5-[2-(1-piperidyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 3-hydroxy-5-[2-(1-piperidinyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 3-hydroxy-5-(2-piperidin-1-ylethyl)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 3-hydroxy-5-(2-piperidinoethyl)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C23H25F3N2O2S MolecularWeight: 450.51701

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN2C3=CC=CC=C3SC(C(C2=O)O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)CCN2C3=CC=CC=C3SC(C(C2=O)O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H25F3N2O2S/c24-23(25,26)17-10-8-16(9-11-17)21-20(29)22(30)28(15-14-27-12-4-1-5-13-27)18-6-2-3-7-19(18)31-21/h2-3,6-11,20-21,29H,1,4-5,12-15H2