[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-[1-(phenylmethyl)pyrazol-4-yl]methanone

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-[1-(phenylmethyl)pyrazol-4-yl]methanone Openeye Name: (1-benzylpyrazol-4-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-[1-(phenylmethyl)-4-pyrazolyl]methanone IUPAC Name: (1-benzylpyrazol-4-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (1-benzylpyrazol-4-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazino]methanone Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H26N4O3S/c1-18-8-9-22(14-19(18)2)31(29,30)27-12-10-25(11-13-27)23(28)21-15-24-26(17-21)16-20-6-4-3-5-7-20/h3-9,14-15,17H,10-13,16H2,1-2H3