2-[4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 2-[4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 2-[4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonyl]-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 2-[4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylpiperazino]pyrimidine Formula: C19H22N6O2S MolecularWeight: 398.48198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H22N6O2S/c1-15-18(16(2)25(22-15)17-7-4-3-5-8-17)28(26,27)24-13-11-23(12-14-24)19-20-9-6-10-21-19/h3-10H,11-14H2,1-2H3