Vitas-M small molecule compound
5-[(2-methylbenzyl)sulfanyl]-3-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-1H-1,2,4-triazole
Catalog ID
STL168467
SMILES Cc1ccccc1CSc1[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 C17H16N6O2S MW 368.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N6O2S/c1-12-5-2-3-7-14(12)11-26-17-19-16(21-22-17)20-18-10-13-6-4-8-15(9-13)23(24)25/h2-10H,11H2,1H3,(H2,19,20,21,22)/b18-10+InChIKey
UNBCBNHTOCSQQZ-VCHYOVAHSA-NSynonyms
827594-04-73((2methylphenyl)methylsulfanyl)N((E)(3nitrophenyl)methylideneamino)1H124triazol5amine
5((2methylbenzyl)sulfanyl)3((2E)2(3nitrobenzylidene)hydrazinyl)1H124triazole
827594047
CC1=CC=CC=C1CSC2=NNC(=N2)NN=CC3=CC(=CC=C3)(N+)(=O)(O)
Cc1ccccc1CSc1(nH)nc(n1)NN=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC17H16N6O2Sc112523714(12)1126171916(212217)2018101364815(913)23(24)25h210H11H21H3(H219202122)b1810+
MFCD20732071
ZINC000006318946
ZINC35668601
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