4-[3-(4-chlorophenyl)-5-(1-propylpiperidin-4-yl)-1H-pyrazol-4-yl]pyrimidine

Systemtic Name: 4-[3-(4-chlorophenyl)-5-(1-propylpiperidin-4-yl)-1H-pyrazol-4-yl]pyrimidine Openeye Name: 4-[3-(4-chlorophenyl)-5-(1-propyl-4-piperidyl)-1H-pyrazol-4-yl]pyrimidine CAS Name: 4-[3-(4-chlorophenyl)-5-(1-propyl-4-piperidinyl)-1H-pyrazol-4-yl]pyrimidine IUPAC Name: 4-[3-(4-chlorophenyl)-5-(1-propylpiperidin-4-yl)-1H-pyrazol-4-yl]pyrimidine Traditional Name: 4-[3-(4-chlorophenyl)-5-(1-propyl-4-piperidyl)-1H-pyrazol-4-yl]pyrimidine Formula: C21H24ClN5 MolecularWeight: 381.90176

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=NC=NC=C4

Isomeric SMILES

CCCN1CCC(CC1)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=NC=NC=C4

InChI

InChI=1S/C21H24ClN5/c1-2-11-27-12-8-16(9-13-27)21-19(18-7-10-23-14-24-18)20(25-26-21)15-3-5-17(22)6-4-15/h3-7,10,14,16H,2,8-9,11-13H2,1H3,(H,25,26)