Vitas-M small molecule compound
3-[3-oxo-5-(2-oxopropyl)-3,5-dihydro[1,2,4]triazino[2,3-a]benzimidazol-2-yl]propanoic acid
Catalog ID
STL444100
SMILES OC(=O)CCc1nn2c3ccccc3n(c2nc1=O)CC(=O)C
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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 C15H14N4O4 MW 314.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O4/c1-9(20)8-18-11-4-2-3-5-12(11)19-15(18)16-14(23)10(17-19)6-7-13(21)22/h2-5H,6-8H2,1H3,(H,21,22)InChIKey
AZYWKIIWRUIEAR-UHFFFAOYSA-NSynonyms
3(3OXO5(2OXOPROPYL)(124)TRIAZINO(23A)BENZIMIDAZOL2YL)PROPANOICACID
3(3oxo5(2oxopropyl)35dihydro(124)triazino(23a)benzimidazol2yl)propanoicacid
CC(=O)CN1C2=CC=CC=C2N3C1=NC(=O)C(=N3)CCC(=O)O
InChI=1SC15H14N4O4c19(20)81811423512(11)1915(18)1614(23)10(1719)6713(21)22h25H68H21H3(H2122)
MFCD02324132
ZINC000000090517
ZINC90517
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