1-(4-butylphenyl)sulfonyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine

Systemtic Name: 1-(4-butylphenyl)sulfonyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine Openeye Name: 1-(4-butylphenyl)sulfonyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine CAS Name: 1-(4-butylphenyl)sulfonyl-4-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]piperazine IUPAC Name: 1-(4-butylphenyl)sulfonyl-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperazine Traditional Name: 1-(4-butylphenyl)sulfonyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine Formula: C21H32N4O2S MolecularWeight: 404.56938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CN(N=C3C)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CN(N=C3C)CC

InChI

InChI=1S/C21H32N4O2S/c1-4-6-7-19-8-10-21(11-9-19)28(26,27)25-14-12-23(13-15-25)16-20-17-24(5-2)22-18(20)3/h8-11,17H,4-7,12-16H2,1-3H3