N-(2,6-dimethylphenyl)-4-[2-[(5-fluoranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-butanamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[2-[(5-fluoranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-butanamide Openeye Name: N-(2,6-dimethylphenyl)-4-[2-(5-fluoro-2-methyl-anilino)-2-oxo-ethyl]sulfanyl-butanamide CAS Name: N-(2,6-dimethylphenyl)-4-[[2-(5-fluoro-2-methylanilino)-2-oxoethyl]thio]butanamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[2-(5-fluoro-2-methylanilino)-2-oxoethyl]sulfanylbutanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[[2-(5-fluoro-2-methyl-anilino)-2-keto-ethyl]thio]butyramide Formula: C21H25FN2O2S MolecularWeight: 388.498803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25FN2O2S/c1-14-9-10-17(22)12-18(14)23-20(26)13-27-11-5-8-19(25)24-21-15(2)6-4-7-16(21)3/h4,6-7,9-10,12H,5,8,11,13H2,1-3H3,(H,23,26)(H,24,25)