1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide Openeye Name: N-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-4-carboxamide CAS Name: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[4-methyl-3-(1-pyrrolidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(4-methyl-3-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: N-(4-methyl-3-pyrrolidinosulfonyl-phenyl)-1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]isonipecotamide Formula: C27H33N5O4S MolecularWeight: 523.64702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)CC3=NC(=NO3)C4=CC(=CC=C4)C)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)CC3=NC(=NO3)C4=CC(=CC=C4)C)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C27H33N5O4S/c1-19-6-5-7-22(16-19)26-29-25(36-30-26)18-31-14-10-21(11-15-31)27(33)28-23-9-8-20(2)24(17-23)37(34,35)32-12-3-4-13-32/h5-9,16-17,21H,3-4,10-15,18H2,1-2H3,(H,28,33)