2-azanyl-N,N-bis(cyanomethyl)-4,5-dimethyl-benzenesulfonamide

Systemtic Name: 2-azanyl-N,N-bis(cyanomethyl)-4,5-dimethyl-benzenesulfonamide Openeye Name: 2-amino-N,N-bis(cyanomethyl)-4,5-dimethyl-benzenesulfonamide CAS Name: 2-amino-N,N-bis(cyanomethyl)-4,5-dimethylbenzenesulfonamide IUPAC Name: 2-amino-N,N-bis(cyanomethyl)-4,5-dimethylbenzenesulfonamide Traditional Name: 2-amino-N,N-bis(cyanomethyl)-4,5-dimethyl-benzenesulfonamide Formula: C12H14N4O2S MolecularWeight: 278.33016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)N(CC#N)CC#N)N

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)N(CC#N)CC#N)N

InChI

InChI=1S/C12H14N4O2S/c1-9-7-11(15)12(8-10(9)2)19(17,18)16(5-3-13)6-4-14/h7-8H,5-6,15H2,1-2H3