1-(4-butylphenyl)sulfonyl-4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine

Systemtic Name: 1-(4-butylphenyl)sulfonyl-4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine Openeye Name: 1-(4-butylphenyl)sulfonyl-4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine CAS Name: 1-(4-butylphenyl)sulfonyl-4-[(1,3-dimethyl-4-pyrazolyl)methyl]piperazine IUPAC Name: 1-(4-butylphenyl)sulfonyl-4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine Traditional Name: 1-(4-butylphenyl)sulfonyl-4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine Formula: C20H30N4O2S MolecularWeight: 390.5428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N4O2S/c1-4-5-6-18-7-9-20(10-8-18)27(25,26)24-13-11-23(12-14-24)16-19-15-22(3)21-17(19)2/h7-10,15H,4-6,11-14,16H2,1-3H3