methyl 2-[1-[(3-aminophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[1-[(3-aminophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate Openeye Name: methyl 2-[2-(3-aminoanilino)-1-methyl-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[1-(3-aminoanilino)-1-oxopropan-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[1-(3-aminoanilino)-1-oxopropan-2-yl]sulfanylacetate Traditional Name: 2-[[2-(3-aminoanilino)-2-keto-1-methyl-ethyl]thio]acetic acid methyl ester Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)N)SCC(=O)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)N)SCC(=O)OC

InChI

InChI=1S/C12H16N2O3S/c1-8(18-7-11(15)17-2)12(16)14-10-5-3-4-9(13)6-10/h3-6,8H,7,13H2,1-2H3,(H,14,16)