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

Systemtic Name: 1-[3-tert-butyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonyl-piperazine CAS Name: 1-[[3-tert-butyl-1-(phenylmethyl)-4-pyrazolyl]sulfonyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-(1-benzyl-3-tert-butylpyrazol-4-yl)sulfonylpiperazine Traditional Name: 1-benzyl-4-(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonyl-piperazine Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H32N4O2S/c1-25(2,3)24-23(20-28(26-24)19-22-12-8-5-9-13-22)32(30,31)29-16-14-27(15-17-29)18-21-10-6-4-7-11-21/h4-13,20H,14-19H2,1-3H3