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

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

Isomeric SMILES

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

InChI

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