methyl 3-[2-[[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-[[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-[[2-(2-ethylanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-[[2-(2-ethylanilino)-2-oxoethyl]amino]-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[[2-(2-ethylanilino)-2-oxoethyl]amino]-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-[[2-(2-ethylanilino)-2-keto-ethyl]amino]-2-keto-ethyl]thio]propionic acid methyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)CSCCC(=O)OC

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)CSCCC(=O)OC

InChI

InChI=1S/C16H22N2O4S/c1-3-12-6-4-5-7-13(12)18-14(19)10-17-15(20)11-23-9-8-16(21)22-2/h4-7H,3,8-11H2,1-2H3,(H,17,20)(H,18,19)