Vitas-M small molecule compound
ethyl 4-[({[5-({[(4-methoxyphenyl)carbonyl]amino}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK118550
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1C)CNC(=O)c1ccc(cc1)OC
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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 C23H25N5O5S MW 483.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O5S/c1-4-33-22(31)16-5-9-17(10-6-16)25-20(29)14-34-23-27-26-19(28(23)2)13-24-21(30)15-7-11-18(32-3)12-8-15/h5-12H,4,13-14H2,1-3H3,(H,24,30)(H,25,29)InChIKey
AURMAKAOGWSRTL-UHFFFAOYSA-NSynonyms
4(2(5((4METHOXYBENZOYLAMINO)METHYL)4METHYL4H(124)TRIAZOL3YLSULFANYL)ACETYLAMINO)BENZOICACIDETHYLESTER
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)CNC(=O)C3=CC=C(C=C3)OC
ETHYL4((((5((((4METHOXYPHENYL)CARBONYL)AMINO)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((((5(((4METHOXYBENZOYL)AMINO)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2((5(((4METHOXYBENZOYL)AMINO)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC23H25N5O5Sc143322(31)165917(10616)2520(29)143423272619(28(23)2)132421(30)1571118(323)12815h512H41314H213H3(H2430)(H2529)
MFCD04127928
ZINC000008442032
ZINC08442032
ZINC8442032
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.