2-(4-azanylcyclohexyl)-4-(4-chlorophenyl)-3-pyridin-4-yl-1H-pyrazol-5-one

Systemtic Name: 2-(4-azanylcyclohexyl)-4-(4-chlorophenyl)-3-pyridin-4-yl-1H-pyrazol-5-one Openeye Name: 2-(4-aminocyclohexyl)-4-(4-chlorophenyl)-3-(4-pyridyl)-1H-pyrazol-5-one CAS Name: 2-(4-aminocyclohexyl)-4-(4-chlorophenyl)-3-pyridin-4-yl-1H-pyrazol-5-one IUPAC Name: 2-(4-aminocyclohexyl)-4-(4-chlorophenyl)-3-pyridin-4-yl-1H-pyrazol-5-one Traditional Name: 1-(4-aminocyclohexyl)-4-(4-chlorophenyl)-5-(4-pyridyl)-3-pyrazolin-3-one Formula: C20H21ClN4O MolecularWeight: 368.85994

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N2C(=C(C(=O)N2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

C1CC(CCC1N)N2C(=C(C(=O)N2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C20H21ClN4O/c21-15-3-1-13(2-4-15)18-19(14-9-11-23-12-10-14)25(24-20(18)26)17-7-5-16(22)6-8-17/h1-4,9-12,16-17H,5-8,22H2,(H,24,26)