3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)sulfonyl-4-piperidyl]methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)sulfonyl-4-piperidyl]methanone Formula: C21H23FN2O3S2 MolecularWeight: 434.547323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23FN2O3S2/c22-17-6-8-18(9-7-17)29(26,27)23-13-10-16(11-14-23)21(25)24-12-3-15-28-20-5-2-1-4-19(20)24/h1-2,4-9,16H,3,10-15H2