Vitas-M small molecule compound
3-[(4-chlorophenoxy)methyl]-4-ethyl-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STL026036
SMILES CCn1c(nnc1COc1ccc(cc1)Cl)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 C18H17ClN4O3S MW 404.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O3S/c1-2-22-17(11-26-16-9-5-14(19)6-10-16)20-21-18(22)27-12-13-3-7-15(8-4-13)23(24)25/h3-10H,2,11-12H2,1H3InChIKey
QWIGNKJRCORAAH-UHFFFAOYSA-NSynonyms
714942-99-13((4chlorophenoxy)methyl)4ethyl5((4nitrobenzyl)sulfanyl)4H124triazole
3((4chlorophenoxy)methyl)4ethyl5((4nitrobenzyl)thio)4H124triazole
3((4CHLOROPHENOXY)METHYL)4ETHYL5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOLE
3(4CHLOROPHENOXYMETHYL)4ETHYL5(((4NITROPHENYL)METHYL)SULFANYL)4H124TRIAZOLE
4CHLORO1((4ETHYL5((4NITROPHENYL)METHYLTHIO)(124TRIAZOL3YL))METHOXY)BENZENE
714942991
CCN1C(=NN=C1SCC2=CC=C(C=C2)(N+)(=O)(O))COC3=CC=C(C=C3)Cl
CCn1c(nnc1COc1ccc(cc1)Cl)SCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H17ClN4O3Sc122217(1126169514(19)61016)202118(22)2712133715(8413)23(24)25h310H21112H21H3
MFCD05687011
ZINC000005500385
ZINC05500385
ZINC5500385
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