ethyl 2-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(3-chloro-2-methylanilino)-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C13H16ClNO3S MolecularWeight: 301.78904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=C(C(=CC=C1)Cl)C

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=C(C(=CC=C1)Cl)C

InChI

InChI=1S/C13H16ClNO3S/c1-3-18-13(17)8-19-7-12(16)15-11-6-4-5-10(14)9(11)2/h4-6H,3,7-8H2,1-2H3,(H,15,16)