N-cyclohexyl-N-methyl-4-[4-(pyrazol-1-ylmethyl)phenyl]carbonyl-piperazine-1-sulfonamide

Systemtic Name: N-cyclohexyl-N-methyl-4-[4-(pyrazol-1-ylmethyl)phenyl]carbonyl-piperazine-1-sulfonamide Openeye Name: N-cyclohexyl-N-methyl-4-[4-(pyrazol-1-ylmethyl)benzoyl]piperazine-1-sulfonamide CAS Name: N-cyclohexyl-N-methyl-4-[oxo-[4-(1-pyrazolylmethyl)phenyl]methyl]-1-piperazinesulfonamide IUPAC Name: N-cyclohexyl-N-methyl-4-[4-(pyrazol-1-ylmethyl)benzoyl]piperazine-1-sulfonamide Traditional Name: N-cyclohexyl-N-methyl-4-[4-(pyrazol-1-ylmethyl)benzoyl]piperazine-1-sulfonamide Formula: C22H31N5O3S MolecularWeight: 445.57824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C22H31N5O3S/c1-24(21-6-3-2-4-7-21)31(29,30)27-16-14-25(15-17-27)22(28)20-10-8-19(9-11-20)18-26-13-5-12-23-26/h5,8-13,21H,2-4,6-7,14-18H2,1H3