methyl 3-[2-[(2,4-dichlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-[(2,4-dichlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-[(2,4-dichlorophenyl)methylamino]-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-[(2,4-dichlorobenzyl)amino]-2-keto-ethyl]thio]propionic acid methyl ester Formula: C13H15Cl2NO3S MolecularWeight: 336.2341

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)NCC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

COC(=O)CCSCC(=O)NCC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C13H15Cl2NO3S/c1-19-13(18)4-5-20-8-12(17)16-7-9-2-3-10(14)6-11(9)15/h2-3,6H,4-5,7-8H2,1H3,(H,16,17)