2-methyl-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-methyl-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-methyl-N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-methyl-N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-methyl-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-methyl-N-[3-[4-(m-tolyl)piperazino]propyl]-5-piperidinosulfonyl-benzamide Formula: C27H38N4O3S MolecularWeight: 498.68062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C27H38N4O3S/c1-22-8-6-9-24(20-22)30-18-16-29(17-19-30)13-7-12-28-27(32)26-21-25(11-10-23(26)2)35(33,34)31-14-4-3-5-15-31/h6,8-11,20-21H,3-5,7,12-19H2,1-2H3,(H,28,32)