1-(3-chlorophenyl)-4-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-piperazine

Systemtic Name: 1-(3-chlorophenyl)-4-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-piperazine Openeye Name: 1-(1-benzyl-3-methyl-pyrazol-4-yl)sulfonyl-4-(3-chlorophenyl)piperazine CAS Name: 1-(3-chlorophenyl)-4-[[3-methyl-1-(phenylmethyl)-4-pyrazolyl]sulfonyl]piperazine IUPAC Name: 1-(1-benzyl-3-methylpyrazol-4-yl)sulfonyl-4-(3-chlorophenyl)piperazine Traditional Name: 1-(1-benzyl-3-methyl-pyrazol-4-yl)sulfonyl-4-(3-chlorophenyl)piperazine Formula: C21H23ClN4O2S MolecularWeight: 430.95092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C=C1S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H23ClN4O2S/c1-17-21(16-25(23-17)15-18-6-3-2-4-7-18)29(27,28)26-12-10-24(11-13-26)20-9-5-8-19(22)14-20/h2-9,14,16H,10-13,15H2,1H3