[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2-fluorophenyl)sulfanylethanoate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2-fluorophenyl)sulfanylethanoate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 2-(2-fluorophenyl)sulfanylacetate CAS Name: 2-[(2-fluorophenyl)thio]acetic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 2-(2-fluorophenyl)sulfanylacetate Traditional Name: 2-[(2-fluorophenyl)thio]acetic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C18H18FNO3S MolecularWeight: 347.403823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CSC2=CC=CC=C2F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CSC2=CC=CC=C2F)C

InChI

InChI=1S/C18H18FNO3S/c1-12-7-8-14(9-13(12)2)20-17(21)10-23-18(22)11-24-16-6-4-3-5-15(16)19/h3-9H,10-11H2,1-2H3,(H,20,21)