Vitas-M small molecule compound
3-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-5-[(2,4,6-trimethylbenzyl)sulfanyl]-1H-1,2,4-triazole
Catalog ID
STL168468
SMILES Cc1cc(C)c(c(c1)C)CSc1[nH]nc(n1)N/N=C/c1cccc(c1)[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 C19H20N6O2S MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N6O2S/c1-12-7-13(2)17(14(3)8-12)11-28-19-21-18(23-24-19)22-20-10-15-5-4-6-16(9-15)25(26)27/h4-10H,11H2,1-3H3,(H2,21,22,23,24)/b20-10+InChIKey
YYDGPJHHDWEGNU-KEBDBYFISA-NSynonyms
827593-96-43((2E)2(3nitrobenzylidene)hydrazinyl)5((246trimethylbenzyl)sulfanyl)1H124triazole
827593964
CC1=CC(=C(C(=C1)C)CSC2=NNC(=N2)NN=CC3=CC(=CC=C3)(N+)(=O)(O))C
Cc1cc(C)c(c(c1)C)CSc1(nH)nc(n1)NN=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC19H20N6O2Sc112713(2)17(14(3)812)1128192118(232419)2220101554616(915)25(26)27h410H11H213H3(H221222324)b2010+
MFCD20732072
N((E)(3nitrophenyl)methylideneamino)3((246trimethylphenyl)methylsulfanyl)1H124triazol5amine
ZINC000008548854
ZINC35668570
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