N-[[4-[(2-butylsulfanylethanoylamino)carbamoyl]phenyl]methyl]-N,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[[4-[(2-butylsulfanylethanoylamino)carbamoyl]phenyl]methyl]-N,4-dimethyl-benzenesulfonamide Openeye Name: N-[[4-[[(2-butylsulfanylacetyl)amino]carbamoyl]phenyl]methyl]-N,4-dimethyl-benzenesulfonamide CAS Name: N-[[4-[[[2-(butylthio)-1-oxoethyl]hydrazo]-oxomethyl]phenyl]methyl]-N,4-dimethylbenzenesulfonamide IUPAC Name: N-[[4-[[(2-butylsulfanylacetyl)amino]carbamoyl]phenyl]methyl]-N,4-dimethylbenzenesulfonamide Traditional Name: N-[4-[[[2-(butylthio)acetyl]amino]carbamoyl]benzyl]-N,4-dimethyl-benzenesulfonamide Formula: C22H29N3O4S2 MolecularWeight: 463.61336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NNC(=O)C1=CC=C(C=C1)CN(C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCSCC(=O)NNC(=O)C1=CC=C(C=C1)CN(C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H29N3O4S2/c1-4-5-14-30-16-21(26)23-24-22(27)19-10-8-18(9-11-19)15-25(3)31(28,29)20-12-6-17(2)7-13-20/h6-13H,4-5,14-16H2,1-3H3,(H,23,26)(H,24,27)