[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: [3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: [3-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolyl]-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: [3-(3,4-dimethylphenyl)-1-phenylpyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: [3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]-(4-mesylpiperazino)methanone Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4)C

InChI

InChI=1S/C23H26N4O3S/c1-17-9-10-19(15-18(17)2)22-21(16-27(24-22)20-7-5-4-6-8-20)23(28)25-11-13-26(14-12-25)31(3,29)30/h4-10,15-16H,11-14H2,1-3H3