4-butyl-N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]cyclohexane-1-carboxamide

Systemtic Name: 4-butyl-N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]cyclohexane-1-carboxamide Openeye Name: 4-butyl-N-[2-[4-(m-tolyl)piperazin-1-yl]sulfonylethyl]cyclohexanecarboxamide CAS Name: 4-butyl-N-[2-[[4-(3-methylphenyl)-1-piperazinyl]sulfonyl]ethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-butyl-N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]cyclohexane-1-carboxamide Traditional Name: 4-butyl-N-[2-[4-(m-tolyl)piperazino]sulfonylethyl]cyclohexanecarboxamide Formula: C24H39N3O3S MolecularWeight: 449.64976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C

InChI

InChI=1S/C24H39N3O3S/c1-3-4-7-21-9-11-22(12-10-21)24(28)25-13-18-31(29,30)27-16-14-26(15-17-27)23-8-5-6-20(2)19-23/h5-6,8,19,21-22H,3-4,7,9-18H2,1-2H3,(H,25,28)