1-(4-butylphenyl)sulfonyl-4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]piperazine

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(N(N=C3)CC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(N(N=C3)CC)C

InChI

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