2-azanyl-3-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-(2,4-dimethylanilino)-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-(2,4-dimethylanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-(2,4-dimethylanilino)-2-keto-ethyl]thio]propionic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSCC(C(=O)O)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSCC(C(=O)O)N)C

InChI

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