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

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 2-[4-(4-chlorobenzoyl)piperazino]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C23H26ClN3O2S MolecularWeight: 443.98944

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H26ClN3O2S/c1-17-10-11-27(20-4-2-3-5-21(20)30-17)22(28)16-25-12-14-26(15-13-25)23(29)18-6-8-19(24)9-7-18/h2-9,17H,10-16H2,1H3