methyl 3-[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-(2-chloro-4,6-dimethyl-anilino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-(2-chloro-4,6-dimethyl-anilino)-2-keto-ethyl]thio]propionic acid methyl ester Formula: C14H18ClNO3S MolecularWeight: 315.81562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CSCCC(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CSCCC(=O)OC)C

InChI

InChI=1S/C14H18ClNO3S/c1-9-6-10(2)14(11(15)7-9)16-12(17)8-20-5-4-13(18)19-3/h6-7H,4-5,8H2,1-3H3,(H,16,17)