3-[[2-[(4-cyanophenyl)methylsulfanyl]ethanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[2-[(4-cyanophenyl)methylsulfanyl]ethanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[[2-[(4-cyanophenyl)methylsulfanyl]acetyl]amino]carbamoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[2-[(4-cyanophenyl)methylthio]-1-oxoethyl]hydrazo]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[[2-[(4-cyanophenyl)methylsulfanyl]acetyl]amino]carbamoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[[2-[(4-cyanobenzyl)thio]acetyl]amino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Formula: C19H20N4O4S2 MolecularWeight: 432.5165

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CSCC2=CC=C(C=C2)C#N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CSCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H20N4O4S2/c1-23(2)29(26,27)17-5-3-4-16(10-17)19(25)22-21-18(24)13-28-12-15-8-6-14(11-20)7-9-15/h3-10H,12-13H2,1-2H3,(H,21,24)(H,22,25)