1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-4-[4-(2-methylpropyl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-4-[4-(2-methylpropyl)phenyl]sulfonyl-piperazine Openeye Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-4-(4-isobutylphenyl)sulfonyl-piperazine CAS Name: 1-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-4-[4-(2-methylpropyl)phenyl]sulfonylpiperazine IUPAC Name: 1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-[4-(2-methylpropyl)phenyl]sulfonylpiperazine Traditional Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-4-(4-isobutylphenyl)sulfonyl-piperazine Formula: C21H32N4O2S MolecularWeight: 404.56938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)CC(C)C)C

Isomeric SMILES

CCN1C(=C(C=N1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)CC(C)C)C

InChI

InChI=1S/C21H32N4O2S/c1-5-25-18(4)20(15-22-25)16-23-10-12-24(13-11-23)28(26,27)21-8-6-19(7-9-21)14-17(2)3/h6-9,15,17H,5,10-14,16H2,1-4H3