methyl 2-[3-[(3-azanyl-2-methyl-phenyl)amino]-3-oxidanylidene-propyl]sulfanylethanoate

Systemtic Name: methyl 2-[3-[(3-azanyl-2-methyl-phenyl)amino]-3-oxidanylidene-propyl]sulfanylethanoate Openeye Name: methyl 2-[3-(3-amino-2-methyl-anilino)-3-oxo-propyl]sulfanylacetate CAS Name: 2-[[3-(3-amino-2-methylanilino)-3-oxopropyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[3-(3-amino-2-methylanilino)-3-oxopropyl]sulfanylacetate Traditional Name: 2-[[3-(3-amino-2-methyl-anilino)-3-keto-propyl]thio]acetic acid methyl ester Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCSCC(=O)OC)N

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCSCC(=O)OC)N

InChI

InChI=1S/C13H18N2O3S/c1-9-10(14)4-3-5-11(9)15-12(16)6-7-19-8-13(17)18-2/h3-5H,6-8,14H2,1-2H3,(H,15,16)