N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-(o-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-[[2-(2-methyl-1-imidazolyl)phenyl]methyl]-1-[(2-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: 1-(2-methylbenzyl)sulfonyl-N-[2-(2-methylimidazol-1-yl)benzyl]isonipecotamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3N4C=CN=C4C

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3N4C=CN=C4C

InChI

InChI=1S/C25H30N4O3S/c1-19-7-3-4-9-23(19)18-33(31,32)28-14-11-21(12-15-28)25(30)27-17-22-8-5-6-10-24(22)29-16-13-26-20(29)2/h3-10,13,16,21H,11-12,14-15,17-18H2,1-2H3,(H,27,30)