Vitas-M small molecule compound
2-[(4-ethyl-5-{[(1-methylnaphthalen-2-yl)oxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(3-nitrophenyl)ethanone
Catalog ID
STK232389
SMILES CCn1c(COc2ccc3c(c2C)cccc3)nnc1SCC(=O)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 C24H22N4O4S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O4S/c1-3-27-23(14-32-22-12-11-17-7-4-5-10-20(17)16(22)2)25-26-24(27)33-15-21(29)18-8-6-9-19(13-18)28(30)31/h4-13H,3,14-15H2,1-2H3InChIKey
GMFZJTANBSDHLT-UHFFFAOYSA-NSynonyms
2((4ETHYL5(((1METHYLNAPHTHALEN2YL)OXY)METHYL)4H124TRIAZOL3YL)SULFANYL)1(3NITROPHENYL)ETHANONE
2((4ETHYL5((1METHYLNAPHTHALEN2YL)OXYMETHYL)124TRIAZOL3YL)SULFANYL)1(3NITROPHENYL)ETHANONE
CCN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)(N+)(=O)(O))COC3=C(C4=CC=CC=C4C=C3)C
CCn1c(COc2ccc3c(c2C)cccc3)nnc1SCC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC24H22N4O4Sc132723(1432221211177451020(17)16(22)2)252624(27)331521(29)1886919(1318)28(30)31h413H31415H212H3
MFCD06627839
ZINC000002880177
ZINC02880177
ZINC2880177
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