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

Systemtic Name: 4-[5-(4-chlorophenyl)-3-(3,5-dimethylpiperazin-1-yl)-1H-pyrazol-4-yl]pyrimidine Openeye Name: 4-[5-(4-chlorophenyl)-3-(3,5-dimethylpiperazin-1-yl)-1H-pyrazol-4-yl]pyrimidine CAS Name: 4-[5-(4-chlorophenyl)-3-(3,5-dimethyl-1-piperazinyl)-1H-pyrazol-4-yl]pyrimidine IUPAC Name: 4-[5-(4-chlorophenyl)-3-(3,5-dimethylpiperazin-1-yl)-1H-pyrazol-4-yl]pyrimidine Traditional Name: 4-[5-(4-chlorophenyl)-3-(3,5-dimethylpiperazino)-1H-pyrazol-4-yl]pyrimidine Formula: C19H21ClN6 MolecularWeight: 368.86324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=NNC(=C2C3=NC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1CN(CC(N1)C)C2=NNC(=C2C3=NC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H21ClN6/c1-12-9-26(10-13(2)23-12)19-17(16-7-8-21-11-22-16)18(24-25-19)14-3-5-15(20)6-4-14/h3-8,11-13,23H,9-10H2,1-2H3,(H,24,25)