2-[[2-[(3-cyano-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoic acid

Systemtic Name: 2-[[2-[(3-cyano-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoic acid Openeye Name: 2-[[2-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-2-oxo-ethyl]-methyl-amino]acetic acid CAS Name: 2-[[2-[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-2-oxoethyl]-methylamino]acetic acid IUPAC Name: 2-[[2-[(3-cyano-4,5-dimethylthiophen-2-yl)amino]-2-oxoethyl]-methylamino]acetic acid Traditional Name: 2-[[2-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-2-keto-ethyl]-methyl-amino]acetic acid Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CN(C)CC(=O)O)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CN(C)CC(=O)O)C

InChI

InChI=1S/C12H15N3O3S/c1-7-8(2)19-12(9(7)4-13)14-10(16)5-15(3)6-11(17)18/h5-6H2,1-3H3,(H,14,16)(H,17,18)