methyl 3-[1-[(5-azanyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[1-[(5-azanyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[2-(5-amino-2-methyl-anilino)-1-methyl-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[1-(5-amino-2-methylanilino)-1-oxopropan-2-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(5-amino-2-methylanilino)-1-oxopropan-2-yl]sulfanylpropanoate Traditional Name: 3-[[2-(5-amino-2-methyl-anilino)-2-keto-1-methyl-ethyl]thio]propionic acid methyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N)NC(=O)C(C)SCCC(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)N)NC(=O)C(C)SCCC(=O)OC

InChI

InChI=1S/C14H20N2O3S/c1-9-4-5-11(15)8-12(9)16-14(18)10(2)20-7-6-13(17)19-3/h4-5,8,10H,6-7,15H2,1-3H3,(H,16,18)