3-[2-[(2-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-[(2-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(2-carbamoylanilino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-(2-carbamoylanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-(2-carbamoylanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-(2-carbamoylanilino)-2-keto-ethyl]thio]propionic acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N)NC(=O)CSCCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N)NC(=O)CSCCC(=O)O

InChI

InChI=1S/C12H14N2O4S/c13-12(18)8-3-1-2-4-9(8)14-10(15)7-19-6-5-11(16)17/h1-4H,5-7H2,(H2,13,18)(H,14,15)(H,16,17)