Vitas-M small molecule compound
ethyl 4-[({[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK597965
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)OCC)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 C28H28N4O5S MW 532.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O5S/c1-3-35-24-16-14-22(15-17-24)32-25(18-37-23-8-6-5-7-9-23)30-31-28(32)38-19-26(33)29-21-12-10-20(11-13-21)27(34)36-4-2/h5-17H,3-4,18-19H2,1-2H3,(H,29,33)InChIKey
NLYCCRAEJOERNM-UHFFFAOYSA-NSynonyms
899410-32-3899410323
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C(=O)OCC)COC4=CC=CC=C4
ethyl4((((4(4ethoxyphenyl)5(phenoxymethyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2((4(4ETHOXYPHENYL)5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4(2((4(4ETHOXYPHENYL)5(PHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZOATE
ethyl4(2((4(4ethoxyphenyl)5(phenoxymethyl)4H124triazol3yl)thio)acetamido)benzoate
ETHYL4(2(4(4ETHOXYPHENYL)5(PHENOXYMETHYL)124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
InChI=1SC28H28N4O5Sc133524161422(151724)3225(1837238657923)303128(32)381926(33)2921121020(111321)27(34)3642h517H341819H212H3(H2933)
MFCD06605039
ZINC000097958386
ZINC97958386
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