Vitas-M small molecule compound
ethyl 4-({[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STK052465
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1C1CCCCC1)c1ccccc1
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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 C25H28N4O3S MW 464.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O3S/c1-2-32-24(31)19-13-15-20(16-14-19)26-22(30)17-33-25-28-27-23(18-9-5-3-6-10-18)29(25)21-11-7-4-8-12-21/h3,5-6,9-10,13-16,21H,2,4,7-8,11-12,17H2,1H3,(H,26,30)InChIKey
PAAISWFAYUWXLD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4
CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1C1CCCCC1)c1ccccc1
ETHYL4((((4CYCLOHEXYL5PHENYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2((4CYCLOHEXYL5PHENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4(2(4CYCLOHEXYL5PHENYL124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
InChI=1SC25H28N4O3Sc123224(31)19131520(161419)2622(30)173325282723(1895361018)29(25)21117481221h356910131621H2478111217H21H3(H2630)
MFCD03194931
STK052465
ZINC000009434813
ZINC09434813
ZINC9434813
Check stock
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