N-(2-cyanoethyl)-N,3-dimethyl-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: N-(2-cyanoethyl)-N,3-dimethyl-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-(2-cyanoethyl)-N,3-dimethyl-pyrazole-4-sulfonamide CAS Name: N-(2-cyanoethyl)-N,3-dimethyl-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-(2-cyanoethyl)-N,3-dimethylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-(2-cyanoethyl)-N,3-dimethyl-pyrazole-4-sulfonamide Formula: C15H18N4O2S MolecularWeight: 318.39402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1S(=O)(=O)N(C)CCC#N)CC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C=C1S(=O)(=O)N(C)CCC#N)CC2=CC=CC=C2

InChI

InChI=1S/C15H18N4O2S/c1-13-15(22(20,21)18(2)10-6-9-16)12-19(17-13)11-14-7-4-3-5-8-14/h3-5,7-8,12H,6,10-11H2,1-2H3