Vitas-M small molecule compound
4-amino-1-[2-(2-nitrophenyl)-2-oxoethyl]-1H-1,2,4-triazol-4-ium
Catalog ID
STL058846
SMILES N[n+]1cnn(c1)CC(=O)c1ccccc1[N+](=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 C10H10N5O3 MW 248.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10N5O3/c11-13-6-12-14(7-13)5-10(16)8-3-1-2-4-9(8)15(17)18/h1-4,6-7H,5,11H2/q+1InChIKey
ORJZHWRRRWMAGA-UHFFFAOYSA-NSynonyms
2(4AMINO124TRIAZOL4IUM1YL)1(2NITROPHENYL)ETHANONE
4AMINO1(2(2NITROPHENYL)2OXOETHYL)1H(124)TRIAZOL4IUM
4amino1(2(2nitrophenyl)2oxoethyl)1H124triazol4ium
4amino1(2(2nitrophenyl)2oxoethyl)1H124triazol4iumbromide
C1=CC=C(C(=C1)C(=O)CN2C=(N+)(C=N2)N)(N+)(=O)(O)
InChI=1SC10H10N5O3c111361214(713)510(16)831249(8)15(17)18h1467H511H2q+1
N(n+)1cnn(c1)CC(=O)c1ccccc1(N+)(=O)(O)
N(n+)1cnn(c1)CC(=O)c1ccccc1(N+)(=O)(O)(Br)
ZINC000017137879
ZINC17137879
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