1-[3-tert-butyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-4-(4-fluorophenyl)piperazine

Systemtic Name: 1-[3-tert-butyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-4-(4-fluorophenyl)piperazine Openeye Name: 1-(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonyl-4-(4-fluorophenyl)piperazine CAS Name: 1-[[3-tert-butyl-1-(phenylmethyl)-4-pyrazolyl]sulfonyl]-4-(4-fluorophenyl)piperazine IUPAC Name: 1-(1-benzyl-3-tert-butylpyrazol-4-yl)sulfonyl-4-(4-fluorophenyl)piperazine Traditional Name: 1-(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonyl-4-(4-fluorophenyl)piperazine Formula: C24H29FN4O2S MolecularWeight: 456.576063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F)CC4=CC=CC=C4

InChI

InChI=1S/C24H29FN4O2S/c1-24(2,3)23-22(18-28(26-23)17-19-7-5-4-6-8-19)32(30,31)29-15-13-27(14-16-29)21-11-9-20(25)10-12-21/h4-12,18H,13-17H2,1-3H3