4-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 4-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 4-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]sulfanyl-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 4-[[2-[3-(methylthio)anilino]-2-oxoethyl]thio]-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 4-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanyl-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: 4-[[2-keto-2-[3-(methylthio)anilino]ethyl]thio]-N-mesityl-butyramide Formula: C22H28N2O2S2 MolecularWeight: 416.59992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CCCSCC(=O)NC2=CC(=CC=C2)SC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CCCSCC(=O)NC2=CC(=CC=C2)SC)C

InChI

InChI=1S/C22H28N2O2S2/c1-15-11-16(2)22(17(3)12-15)24-20(25)9-6-10-28-14-21(26)23-18-7-5-8-19(13-18)27-4/h5,7-8,11-13H,6,9-10,14H2,1-4H3,(H,23,26)(H,24,25)