2-[4-(3-methyl-4-phenyl-pyrazol-1-yl)-1-piperazin-1-yl-butyl]pyrimidine

Systemtic Name: 2-[4-(3-methyl-4-phenyl-pyrazol-1-yl)-1-piperazin-1-yl-butyl]pyrimidine Openeye Name: 2-[4-(3-methyl-4-phenyl-pyrazol-1-yl)-1-piperazin-1-yl-butyl]pyrimidine CAS Name: 2-[4-(3-methyl-4-phenyl-1-pyrazolyl)-1-(1-piperazinyl)butyl]pyrimidine IUPAC Name: 2-[4-(3-methyl-4-phenylpyrazol-1-yl)-1-piperazin-1-ylbutyl]pyrimidine Traditional Name: 2-[4-(3-methyl-4-phenyl-pyrazol-1-yl)-1-piperazino-butyl]pyrimidine Formula: C22H28N6 MolecularWeight: 376.49792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=CC=CC=C2)CCCC(C3=NC=CC=N3)N4CCNCC4

Isomeric SMILES

CC1=NN(C=C1C2=CC=CC=C2)CCCC(C3=NC=CC=N3)N4CCNCC4

InChI

InChI=1S/C22H28N6/c1-18-20(19-7-3-2-4-8-19)17-28(26-18)14-5-9-21(22-24-10-6-11-25-22)27-15-12-23-13-16-27/h2-4,6-8,10-11,17,21,23H,5,9,12-16H2,1H3