3-[(3-methylquinoxalin-2-yl)carbothioylamino]propanoate

Systemtic Name: 3-[(3-methylquinoxalin-2-yl)carbothioylamino]propanoate Openeye Name: 3-[(3-methylquinoxaline-2-carbothioyl)amino]propanoate CAS Name: 3-[[(3-methyl-2-quinoxalinyl)-sulfanylidenemethyl]amino]propanoate IUPAC Name: 3-[(3-methylquinoxaline-2-carbothioyl)amino]propanoate Traditional Name: 3-[(3-methylquinoxaline-2-carbothioyl)amino]propionate Formula: C13H12N3O2S- MolecularWeight: 274.31828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1C(=S)NCCC(=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1C(=S)NCCC(=O)[O-]

InChI

InChI=1S/C13H13N3O2S/c1-8-12(13(19)14-7-6-11(17)18)16-10-5-3-2-4-9(10)15-8/h2-5H,6-7H2,1H3,(H,14,19)(H,17,18)/p-1