2-[4-(cyclobutylmethyl)piperazin-1-yl]-4-[1-(2-methylphenyl)pyrazol-4-yl]pyrimidine

Systemtic Name: 2-[4-(cyclobutylmethyl)piperazin-1-yl]-4-[1-(2-methylphenyl)pyrazol-4-yl]pyrimidine Openeye Name: 2-[4-(cyclobutylmethyl)piperazin-1-yl]-4-[1-(o-tolyl)pyrazol-4-yl]pyrimidine CAS Name: 2-[4-(cyclobutylmethyl)-1-piperazinyl]-4-[1-(2-methylphenyl)-4-pyrazolyl]pyrimidine IUPAC Name: 2-[4-(cyclobutylmethyl)piperazin-1-yl]-4-[1-(2-methylphenyl)pyrazol-4-yl]pyrimidine Traditional Name: 2-[4-(cyclobutylmethyl)piperazino]-4-[1-(o-tolyl)pyrazol-4-yl]pyrimidine Formula: C23H28N6 MolecularWeight: 388.50862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=C(C=N2)C3=NC(=NC=C3)N4CCN(CC4)CC5CCC5

Isomeric SMILES

CC1=CC=CC=C1N2C=C(C=N2)C3=NC(=NC=C3)N4CCN(CC4)CC5CCC5

InChI

InChI=1S/C23H28N6/c1-18-5-2-3-8-22(18)29-17-20(15-25-29)21-9-10-24-23(26-21)28-13-11-27(12-14-28)16-19-6-4-7-19/h2-3,5,8-10,15,17,19H,4,6-7,11-14,16H2,1H3