Vitas-M small molecule compound
7-(4-nitrophenyl)-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Catalog ID
STK274147
SMILES O=c1c(nnc2n1nc(s2)c1ccc(cc1)[N+](=O)[O-])c1ccccc1
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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 C16H9N5O3S MW 351.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9N5O3S/c22-15-13(10-4-2-1-3-5-10)17-18-16-20(15)19-14(25-16)11-6-8-12(9-7-11)21(23)24/h1-9HInChIKey
AXXPDAJJBPETJI-UHFFFAOYSA-NSynonyms
7(4nitrophenyl)3phenyl(134)thiadiazolo(23c)(124)triazin4one
7(4nitrophenyl)3phenyl4H(134)thiadiazolo(23c)(124)triazin4one
C1=CC=C(C=C1)C2=NN=C3N(C2=O)N=C(S3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC16H9N5O3Sc221513(104213510)17181620(15)1914(2516)116812(9711)21(23)24h19H
MFCD09268418
O=c1c(nnc2n1nc(s2)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
ZINC000008393689
ZINC08393689
ZINC8393689
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