Vitas-M small molecule compound
2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(naphthalen-2-yl)ethanone
Catalog ID
STK582042
SMILES CCOc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1COc1ccccc1
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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 C29H25N3O3S MW 495.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O3S/c1-2-34-26-16-14-24(15-17-26)32-28(19-35-25-10-4-3-5-11-25)30-31-29(32)36-20-27(33)23-13-12-21-8-6-7-9-22(21)18-23/h3-18H,2,19-20H2,1H3InChIKey
PKYJONXPRIHEGY-UHFFFAOYSA-NSynonyms
899411-07-52((4(4ETHOXYPHENYL)5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)1NAPHTHALEN2YLETHANONE
2((4(4ethoxyphenyl)5(phenoxymethyl)4H124triazol3yl)sulfanyl)1(naphthalen2yl)ethanone
2((4(4ethoxyphenyl)5(phenoxymethyl)4H124triazol3yl)thio)1(naphthalen2yl)ethanone
899411075
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC4=CC=CC=C4C=C3)COC5=CC=CC=C5
InChI=1SC29H25N3O3Sc123426161424(151726)3228(193525104351125)303129(32)362027(33)23131221867922(21)1823h318H21920H21H3
MFCD06607985
ZINC000002338409
ZINC02338409
ZINC2338409
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