(2S)-2-[[2-(pyridin-3-ylcarbonylamino)-1,3-thiazol-4-yl]carbonylamino]butanoic acid

Systemtic Name: (2S)-2-[[2-(pyridin-3-ylcarbonylamino)-1,3-thiazol-4-yl]carbonylamino]butanoic acid Openeye Name: (2S)-2-[[2-(pyridine-3-carbonylamino)thiazole-4-carbonyl]amino]butanoic acid CAS Name: (2S)-2-[[oxo-[2-[[oxo(3-pyridinyl)methyl]amino]-4-thiazolyl]methyl]amino]butanoic acid IUPAC Name: (2S)-2-[[2-(pyridine-3-carbonylamino)-1,3-thiazole-4-carbonyl]amino]butanoic acid Traditional Name: (2S)-2-[(2-nicotinamidothiazole-4-carbonyl)amino]butyric acid Formula: C14H14N4O4S MolecularWeight: 334.35036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](C(=O)O)NC(=O)C1=CSC(=N1)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C14H14N4O4S/c1-2-9(13(21)22)16-12(20)10-7-23-14(17-10)18-11(19)8-4-3-5-15-6-8/h3-7,9H,2H2,1H3,(H,16,20)(H,21,22)(H,17,18,19)/t9-/m0/s1