Vitas-M small molecule compound
4-ethyl-3-[(4-methylphenoxy)methyl]-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STL061936
SMILES CCn1c(nnc1COc1ccc(cc1)C)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 C19H20N4O3S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O3S/c1-3-22-18(12-26-17-10-4-14(2)5-11-17)20-21-19(22)27-13-15-6-8-16(9-7-15)23(24)25/h4-11H,3,12-13H2,1-2H3InChIKey
NOXQASGGYXCTQR-UHFFFAOYSA-NSynonyms
713090-83-61((4ETHYL5((4NITROPHENYL)METHYLTHIO)(124TRIAZOL3YL))METHOXY)4METHYLBENZENE
4ethyl3((4methylphenoxy)methyl)5((4nitrobenzyl)sulfanyl)4H124triazole
4ETHYL3((4METHYLPHENOXY)METHYL)5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOLE
4ethyl3((4nitrobenzyl)thio)5((ptolyloxy)methyl)4H124triazole
4ETHYL3(4METHYLPHENOXYMETHYL)5(((4NITROPHENYL)METHYL)SULFANYL)4H124TRIAZOLE
713090836
CCN1C(=NN=C1SCC2=CC=C(C=C2)(N+)(=O)(O))COC3=CC=C(C=C3)C
CCn1c(nnc1COc1ccc(cc1)C)SCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H20N4O3Sc132218(12261710414(2)51117)202119(22)2713156816(9715)23(24)25h411H31213H212H3
MFCD05681908
ZINC000005477554
ZINC05477554
ZINC5477554
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