2-[6-[2-(2-chlorophenyl)ethylamino]pyrimidin-4-yl]-4-pyridin-3-yl-1H-pyrazol-3-one

Systemtic Name: 2-[6-[2-(2-chlorophenyl)ethylamino]pyrimidin-4-yl]-4-pyridin-3-yl-1H-pyrazol-3-one Openeye Name: 2-[6-[2-(2-chlorophenyl)ethylamino]pyrimidin-4-yl]-4-(3-pyridyl)-1H-pyrazol-3-one CAS Name: 2-[6-[2-(2-chlorophenyl)ethylamino]-4-pyrimidinyl]-4-(3-pyridinyl)-1H-pyrazol-3-one IUPAC Name: 2-[6-[2-(2-chlorophenyl)ethylamino]pyrimidin-4-yl]-4-pyridin-3-yl-1H-pyrazol-3-one Traditional Name: 2-[6-[2-(2-chlorophenyl)ethylamino]pyrimidin-4-yl]-4-(3-pyridyl)-3-pyrazolin-3-one Formula: C20H17ClN6O MolecularWeight: 392.84158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCNC2=NC=NC(=C2)N3C(=O)C(=CN3)C4=CN=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CCNC2=NC=NC(=C2)N3C(=O)C(=CN3)C4=CN=CC=C4)Cl

InChI

InChI=1S/C20H17ClN6O/c21-17-6-2-1-4-14(17)7-9-23-18-10-19(25-13-24-18)27-20(28)16(12-26-27)15-5-3-8-22-11-15/h1-6,8,10-13,26H,7,9H2,(H,23,24,25)