1-[4-(2-chlorophenyl)piperazin-1-yl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone

Systemtic Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 1-[4-(2-chlorophenyl)-1-piperazinyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 1-[4-(2-chlorophenyl)piperazino]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C21H24ClN3OS MolecularWeight: 401.95276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)CC(=O)N3CCN(CC3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)CC(=O)N3CCN(CC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H24ClN3OS/c22-17-6-1-2-7-18(17)23-11-13-24(14-12-23)21(26)16-25-10-5-15-27-20-9-4-3-8-19(20)25/h1-4,6-9H,5,10-16H2