Vitas-M small molecule compound
2-(5-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-N-(2-ethylphenyl)acetamide
Catalog ID
STK288991
SMILES CCc1ccccc1NC(=O)Cc1nnc(n1C)SCC(=O)N1CCc2c(C1)cccc2
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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 C24H27N5O2S MW 449.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O2S/c1-3-17-8-6-7-11-20(17)25-22(30)14-21-26-27-24(28(21)2)32-16-23(31)29-13-12-18-9-4-5-10-19(18)15-29/h4-11H,3,12-16H2,1-2H3,(H,25,30)InChIKey
LTOULSJUUYOXJE-UHFFFAOYSA-NSynonyms
2(5((2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(2ETHYLPHENYL)ACETAMIDE
2(5(2(34dihydro1Hisoquinolin2yl)2oxoethyl)sulfanyl4methyl124triazol3yl)N(2ethylphenyl)acetamide
CCC1=CC=CC=C1NC(=O)CC2=NN=C(N2C)SCC(=O)N3CCC4=CC=CC=C4C3
InChI=1SC24H27N5O2Sc13178671120(17)2522(30)1421262724(28(21)2)321623(31)291312189451019(18)1529h411H31216H212H3(H2530)
MFCD09039581
ZINC000013567162
ZINC13567162
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