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

Systemtic Name: (4-cyclohexylpiperazin-1-yl)-[3-methyl-1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]methanone Openeye Name: (4-cyclohexylpiperazin-1-yl)-[3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazol-4-yl]methanone CAS Name: (4-cyclohexyl-1-piperazinyl)-[3-methyl-1-(3-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolyl]methanone IUPAC Name: (4-cyclohexylpiperazin-1-yl)-[3-methyl-1-(3-methylphenyl)-5-pyrrol-1-ylpyrazol-4-yl]methanone Traditional Name: (4-cyclohexylpiperazino)-[3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazol-4-yl]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)N3CCN(CC3)C4CCCCC4)N5C=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)C(=O)N3CCN(CC3)C4CCCCC4)N5C=CC=C5

InChI

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