Vitas-M small molecule compound
(2S)-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}(phenyl)ethanoic acid
Catalog ID
STK716948
SMILES O=C(Cn1nnc2c(c1=O)cccc2)N[C@@H](c1ccccc1)C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H14N4O4 MW 338.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O4/c22-14(18-15(17(24)25)11-6-2-1-3-7-11)10-21-16(23)12-8-4-5-9-13(12)19-20-21/h1-9,15H,10H2,(H,18,22)(H,24,25)/t15-/m0/s1InChIKey
VLBDEXDDNFALRB-HNNXBMFYSA-NSynonyms
958984-74-2(2S)(((4oxo123benzotriazin3(4H)yl)acetyl)amino)(phenyl)ethanoicacid
(2S)2((2(4OXO123BENZOTRIAZIN3YL)ACETYL)AMINO)2PHENYLACETICACID
(S)(2(4OXO4HBENZO(D)(123)TRIAZIN3YL)ACETYLAMINO)PHENYLACETICACID
(S)2(2(4oxobenzo(d)(123)triazin3(4H)yl)acetamido)2phenylaceticacid
958984742
C1=CC=C(C=C1)C(C(=O)O)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2
InChI=1SC17H14N4O4c2214(1815(17(24)25)116213711)102116(23)12845913(12)192021h1915H10H2(H1822)(H2425)t15m0s1
MFCD06611251
O=C(Cn1nnc2c(c1=O)cccc2)N(C@@H)(c1ccccc1)C(=O)O
ZINC000002353042
ZINC2353042
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