1-[3-methyl-1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[3-methyl-1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[3-methyl-1-(3-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-methyl-1-(3-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]isonipecotamide Formula: C22H25N5O2 MolecularWeight: 391.4662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)C(=O)N3CCC(CC3)C(=O)N)N4C=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)C(=O)N3CCC(CC3)C(=O)N)N4C=CC=C4

InChI

InChI=1S/C22H25N5O2/c1-15-6-5-7-18(14-15)27-21(25-10-3-4-11-25)19(16(2)24-27)22(29)26-12-8-17(9-13-26)20(23)28/h3-7,10-11,14,17H,8-9,12-13H2,1-2H3,(H2,23,28)