1-(5-chloranyl-2-methyl-phenyl)-4-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-piperazine

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-4-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-piperazine Openeye Name: 1-(1-benzyl-3-phenyl-pyrazol-4-yl)sulfonyl-4-(5-chloro-2-methyl-phenyl)piperazine CAS Name: 1-(5-chloro-2-methylphenyl)-4-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]sulfonyl]piperazine IUPAC Name: 1-(1-benzyl-3-phenylpyrazol-4-yl)sulfonyl-4-(5-chloro-2-methylphenyl)piperazine Traditional Name: 1-(1-benzyl-3-phenyl-pyrazol-4-yl)sulfonyl-4-(5-chloro-2-methyl-phenyl)piperazine Formula: C27H27ClN4O2S MolecularWeight: 507.04688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H27ClN4O2S/c1-21-12-13-24(28)18-25(21)30-14-16-32(17-15-30)35(33,34)26-20-31(19-22-8-4-2-5-9-22)29-27(26)23-10-6-3-7-11-23/h2-13,18,20H,14-17,19H2,1H3