1-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonyl-4-(phenylmethyl)piperazine

Systemtic Name: 1-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonyl-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonyl-piperazine CAS Name: 1-[(3-tert-butyl-1-cyclopentyl-4-pyrazolyl)sulfonyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-(3-tert-butyl-1-cyclopentylpyrazol-4-yl)sulfonylpiperazine Traditional Name: 1-benzyl-4-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonyl-piperazine Formula: C23H34N4O2S MolecularWeight: 430.60666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)C4CCCC4

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)C4CCCC4

InChI

InChI=1S/C23H34N4O2S/c1-23(2,3)22-21(18-27(24-22)20-11-7-8-12-20)30(28,29)26-15-13-25(14-16-26)17-19-9-5-4-6-10-19/h4-6,9-10,18,20H,7-8,11-17H2,1-3H3