3-[[3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]propanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]propanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)propanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[3-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]-1-oxopropyl]hydrazo]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]propanoylamino]carbamoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)propanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Formula: C21H31N5O4S MolecularWeight: 449.56694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CCC(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CCC(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H31N5O4S/c1-14(2)13-26-16(4)19(15(3)24-26)10-11-20(27)22-23-21(28)17-8-7-9-18(12-17)31(29,30)25(5)6/h7-9,12,14H,10-11,13H2,1-6H3,(H,22,27)(H,23,28)