[3-methyl-1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone

Systemtic Name: [3-methyl-1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Openeye Name: [3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazol-4-yl]-[4-(1-piperidyl)-1-piperidyl]methanone CAS Name: [3-methyl-1-(3-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-[4-(1-piperidinyl)-1-piperidinyl]methanone IUPAC Name: [3-methyl-1-(3-methylphenyl)-5-pyrrol-1-ylpyrazol-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Traditional Name: [3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazol-4-yl]-(4-piperidinopiperidino)methanone Formula: C26H33N5O MolecularWeight: 431.57312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)C(=O)N3CCC(CC3)N4CCCCC4)N5C=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)C(=O)N3CCC(CC3)N4CCCCC4)N5C=CC=C5

InChI

InChI=1S/C26H33N5O/c1-20-9-8-10-23(19-20)31-25(29-15-6-7-16-29)24(21(2)27-31)26(32)30-17-11-22(12-18-30)28-13-4-3-5-14-28/h6-10,15-16,19,22H,3-5,11-14,17-18H2,1-2H3