[1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]-(2-methylpiperidin-1-yl)methanone

Systemtic Name: [1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]-(2-methylpiperidin-1-yl)methanone Openeye Name: (2-methyl-1-piperidyl)-[1-(m-tolyl)-5-pyrrol-1-yl-pyrazol-4-yl]methanone CAS Name: [1-(3-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-(2-methyl-1-piperidinyl)methanone IUPAC Name: [1-(3-methylphenyl)-5-pyrrol-1-ylpyrazol-4-yl]-(2-methylpiperidin-1-yl)methanone Traditional Name: (2-methylpiperidino)-[1-(m-tolyl)-5-pyrrol-1-yl-pyrazol-4-yl]methanone Formula: C21H24N4O MolecularWeight: 348.44146

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C)N4C=CC=C4

Isomeric SMILES

CC1CCCCN1C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C)N4C=CC=C4

InChI

InChI=1S/C21H24N4O/c1-16-8-7-10-18(14-16)25-20(23-11-5-6-12-23)19(15-22-25)21(26)24-13-4-3-9-17(24)2/h5-8,10-12,14-15,17H,3-4,9,13H2,1-2H3