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

Systemtic Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-benzoylpiperazin-1-yl)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 2-(4-benzoyl-1-piperazinyl)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 2-(4-benzoylpiperazin-1-yl)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 2-(4-benzoylpiperazino)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O2S/c1-18-11-12-26(20-9-5-6-10-21(20)29-18)22(27)17-24-13-15-25(16-14-24)23(28)19-7-3-2-4-8-19/h2-10,18H,11-17H2,1H3