Vitas-M small molecule compound
3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanoic acid
Catalog ID
STL234073
SMILES CC(C(n1nnc2c(c1=O)cccc2)C(=O)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 C12H13N3O3 MW 247.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3O3/c1-7(2)10(12(17)18)15-11(16)8-5-3-4-6-9(8)13-14-15/h3-7,10H,1-2H3,(H,17,18)InChIKey
CIDCLWSSRNYIAH-UHFFFAOYSA-NSynonyms
105234-47-7(S)3methyl2(4oxobenzo(d)(123)triazin3(4H)yl)butanoicacid
105234477
3methyl2(4oxo123benzotriazin3(4H)yl)butanoicacid
3methyl2(4oxo123benzotriazin3yl)butanoicacid
CC((C@H)(n1nnc2c(c1=O)cccc2)C(=O)O)C
CC(C)C(C(=O)O)N1C(=O)C2=CC=CC=C2N=N1
InChI=1SC12H13N3O3c17(2)10(12(17)18)1511(16)853469(8)131415h3710H12H3(H1718)
MFCD07636866
ZINC000003883080
ZINC000003883081
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