4-[1-(3-methylphenyl)pyrazol-4-yl]-2-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]pyrimidine

Systemtic Name: 4-[1-(3-methylphenyl)pyrazol-4-yl]-2-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]pyrimidine Openeye Name: 4-[1-(m-tolyl)pyrazol-4-yl]-2-[(2S)-2-(2-pyridyl)pyrrolidin-1-yl]pyrimidine CAS Name: 4-[1-(3-methylphenyl)-4-pyrazolyl]-2-[(2S)-2-(2-pyridinyl)-1-pyrrolidinyl]pyrimidine IUPAC Name: 4-[1-(3-methylphenyl)pyrazol-4-yl]-2-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]pyrimidine Traditional Name: 4-[1-(m-tolyl)pyrazol-4-yl]-2-[(2S)-2-(2-pyridyl)pyrrolidino]pyrimidine Formula: C23H22N6 MolecularWeight: 382.46098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=C(C=N2)C3=NC(=NC=C3)N4CCCC4C5=CC=CC=N5

Isomeric SMILES

CC1=CC(=CC=C1)N2C=C(C=N2)C3=NC(=NC=C3)N4CCC[C@H]4C5=CC=CC=N5

InChI

InChI=1S/C23H22N6/c1-17-6-4-7-19(14-17)29-16-18(15-26-29)20-10-12-25-23(27-20)28-13-5-9-22(28)21-8-2-3-11-24-21/h2-4,6-8,10-12,14-16,22H,5,9,13H2,1H3/t22-/m0/s1