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

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-4-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]sulfonyl-piperazine Openeye Name: 1-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]sulfonyl-4-(5-chloro-2-methyl-phenyl)piperazine CAS Name: 1-(5-chloro-2-methylphenyl)-4-[[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]sulfonyl]piperazine IUPAC Name: 1-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)sulfonyl-4-(5-chloro-2-methylphenyl)piperazine Traditional Name: 1-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]sulfonyl-4-(5-chloro-2-methyl-phenyl)piperazine Formula: C25H25ClN4O2S2 MolecularWeight: 513.0746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C25H25ClN4O2S2/c1-19-9-10-21(26)16-22(19)28-11-13-30(14-12-28)34(31,32)24-18-29(17-20-6-3-2-4-7-20)27-25(24)23-8-5-15-33-23/h2-10,15-16,18H,11-14,17H2,1H3