Vitas-M small molecule compound
1-{7-methyl-2-[(4-nitrobenzyl)sulfanyl][1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethanone
Catalog ID
STK235419
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nn2c(n1)ncc(c2C)C(=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 C15H13N5O3S MW 343.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N5O3S/c1-9-13(10(2)21)7-16-14-17-15(18-19(9)14)24-8-11-3-5-12(6-4-11)20(22)23/h3-7H,8H2,1-2H3InChIKey
JVVNHOVEWWEAJO-UHFFFAOYSA-NSynonyms
878994-13-9(O)(N+)(=O)c1ccc(cc1)CSc1nn2c(n1)ncc(c2C)C(=O)C
1(7methyl2((4nitrobenzyl)sulfanyl)(124)triazolo(15a)pyrimidin6yl)ethanone
1(7methyl2((4nitrobenzyl)thio)(124)triazolo(15a)pyrimidin6yl)ethanone
1(7METHYL2((4NITROPHENYL)METHYLSULFANYL)(124)TRIAZOLO(15A)PYRIMIDIN6YL)ETHANONE
6ACETYL7METHYL2((4NITROPHENYL)METHYLTHIO)8HYDRO124TRIAZOLO(15A)PYRIMIDINE
878994139
CC1=C(C=NC2=NC(=NN12)SCC3=CC=C(C=C3)(N+)(=O)(O))C(=O)C
InChI=1SC15H13N5O3Sc1913(10(2)21)716141715(1819(9)14)248113512(6411)20(22)23h37H8H212H3
MFCD07469691
ZINC000005426268
ZINC05426268
ZINC5426268
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