Vitas-M small molecule compound
1,1'-[3-methyl-6-(3-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]diethanone
Catalog ID
STK685967
SMILES CC(=O)c1sc2nnc(n2n(c1c1cccc(c1)[N+](=O)[O-])C(=O)C)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 C15H13N5O4S MW 359.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N5O4S/c1-8(21)14-13(11-5-4-6-12(7-11)20(23)24)19(10(3)22)18-9(2)16-17-15(18)25-14/h4-7H,1-3H3InChIKey
MFBJIOCCILCQCM-UHFFFAOYSA-NSynonyms
1(5ACETYL3METHYL6(3NITROPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZIN7YL)ETHANONE
1(5ACETYL3METHYL6(3NITROPHENYL)5H(124)TRIAZOLO(34B)(134)THIADIAZIN7YL)ETHANONE
1(5ETHANOYL3METHYL6(3NITROPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZIN7YL)ETHANONE
11(3methyl6(3nitrophenyl)5H(124)triazolo(34b)(134)thiadiazine57diyl)diethanone
CC(=O)c1sc2nnc(n2n(c1c1cccc(c1)(N+)(=O)(O))C(=O)C)C
CC1=NN=C2N1N(C(=C(S2)C(=O)C)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C
InChI=1SC15H13N5O4Sc18(21)1413(1154612(711)20(23)24)19(10(3)22)189(2)161715(18)2514h47H13H3
MFCD06014079
ZINC000001432451
ZINC01432451
ZINC1432451
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