1-(1-methylpyrrol-3-yl)sulfonyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(1-methylpyrrol-3-yl)sulfonyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(1-methylpyrrol-3-yl)sulfonyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-[(1-methyl-3-pyrrolyl)sulfonyl]-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(1-methylpyrrol-3-yl)sulfonyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-(1-methylpyrrol-3-yl)sulfonyl-N-[4-(pyrazol-1-ylmethyl)benzyl]isonipecotamide Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C22H27N5O3S/c1-25-12-9-21(17-25)31(29,30)27-13-7-20(8-14-27)22(28)23-15-18-3-5-19(6-4-18)16-26-11-2-10-24-26/h2-6,9-12,17,20H,7-8,13-16H2,1H3,(H,23,28)