1-(4-butylphenyl)sulfonyl-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine

Systemtic Name: 1-(4-butylphenyl)sulfonyl-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine Openeye Name: 1-(4-butylphenyl)sulfonyl-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine CAS Name: 1-(4-butylphenyl)sulfonyl-4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonyl]piperazine IUPAC Name: 1-(4-butylphenyl)sulfonyl-4-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonylpiperazine Traditional Name: 1-(4-butylphenyl)sulfonyl-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine Formula: C25H32N4O4S2 MolecularWeight: 516.67598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=C(N(N=C3C)C4=CC=CC=C4)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=C(N(N=C3C)C4=CC=CC=C4)C

InChI

InChI=1S/C25H32N4O4S2/c1-4-5-9-22-12-14-24(15-13-22)34(30,31)27-16-18-28(19-17-27)35(32,33)25-20(2)26-29(21(25)3)23-10-7-6-8-11-23/h6-8,10-15H,4-5,9,16-19H2,1-3H3