1-(4-butan-2-ylphenyl)sulfonyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine

Systemtic Name: 1-(4-butan-2-ylphenyl)sulfonyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine Openeye Name: 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-(4-sec-butylphenyl)sulfonyl-piperazine CAS Name: 1-(4-butan-2-ylphenyl)sulfonyl-4-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]piperazine IUPAC Name: 1-(4-butan-2-ylphenyl)sulfonyl-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperazine Traditional Name: 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-(4-sec-butylphenyl)sulfonyl-piperazine Formula: C21H32N4O2S MolecularWeight: 404.56938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N4O2S/c1-5-17(3)19-7-9-21(10-8-19)28(26,27)25-13-11-23(12-14-25)15-20-16-24(6-2)22-18(20)4/h7-10,16-17H,5-6,11-15H2,1-4H3