3-tert-butyl-N-cyclohexyl-N-ethyl-1-phenyl-pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-cyclohexyl-N-ethyl-1-phenyl-pyrazole-4-sulfonamide Openeye Name: 3-tert-butyl-N-cyclohexyl-N-ethyl-1-phenyl-pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-cyclohexyl-N-ethyl-1-phenyl-4-pyrazolesulfonamide IUPAC Name: 3-tert-butyl-N-cyclohexyl-N-ethyl-1-phenylpyrazole-4-sulfonamide Traditional Name: 3-tert-butyl-N-cyclohexyl-N-ethyl-1-phenyl-pyrazole-4-sulfonamide Formula: C21H31N3O2S MolecularWeight: 389.55474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)S(=O)(=O)C2=CN(N=C2C(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CCN(C1CCCCC1)S(=O)(=O)C2=CN(N=C2C(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H31N3O2S/c1-5-24(18-14-10-7-11-15-18)27(25,26)19-16-23(17-12-8-6-9-13-17)22-20(19)21(2,3)4/h6,8-9,12-13,16,18H,5,7,10-11,14-15H2,1-4H3