Vitas-M small molecule compound
4-methyl-3-(3-methylphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STL026034
SMILES Cc1cccc(c1)c1nnc(n1C)SCc1ccc(cc1)[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 C17H16N4O2S MW 340.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O2S/c1-12-4-3-5-14(10-12)16-18-19-17(20(16)2)24-11-13-6-8-15(9-7-13)21(22)23/h3-10H,11H2,1-2H3InChIKey
IJCNRUQYVSJYTR-UHFFFAOYSA-NSynonyms
879433-54-24methyl3((4nitrobenzyl)thio)5(mtolyl)4H124triazole
4methyl3(3methylphenyl)5((4nitrobenzyl)sulfanyl)4H124triazole
4METHYL3(3METHYLPHENYL)5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOLE
879433542
CC1=CC=CC(=C1)C2=NN=C(N2C)SCC3=CC=C(C=C3)(N+)(=O)(O)
Cc1cccc(c1)c1nnc(n1C)SCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H16N4O2Sc11243514(1012)16181917(20(16)2)2411136815(9713)21(22)23h310H11H212H3
MFCD06593092
ZINC000002441007
ZINC02441007
ZINC2441007
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