3-[methyl-[[2-(pyridin-3-ylcarbonylamino)-1,3-thiazol-4-yl]carbonyl]amino]propanoate

Systemtic Name: 3-[methyl-[[2-(pyridin-3-ylcarbonylamino)-1,3-thiazol-4-yl]carbonyl]amino]propanoate Openeye Name: 3-[methyl-[2-(pyridine-3-carbonylamino)thiazole-4-carbonyl]amino]propanoate CAS Name: 3-[methyl-[oxo-[2-[[oxo(3-pyridinyl)methyl]amino]-4-thiazolyl]methyl]amino]propanoate IUPAC Name: 3-[methyl-[2-(pyridine-3-carbonylamino)-1,3-thiazole-4-carbonyl]amino]propanoate Traditional Name: 3-[methyl-(2-nicotinamidothiazole-4-carbonyl)amino]propionate Formula: C14H13N4O4S- MolecularWeight: 333.34242

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)[O-])C(=O)C1=CSC(=N1)NC(=O)C2=CN=CC=C2

Isomeric SMILES

CN(CCC(=O)[O-])C(=O)C1=CSC(=N1)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C14H14N4O4S/c1-18(6-4-11(19)20)13(22)10-8-23-14(16-10)17-12(21)9-3-2-5-15-7-9/h2-3,5,7-8H,4,6H2,1H3,(H,19,20)(H,16,17,21)/p-1