Vitas-M small molecule compound
N-{1-[5-({2-[(3-chloro-4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-2-hydroxyethyl}-4-methoxybenzamide
Catalog ID
STK186812
SMILES COc1ccc(cc1)C(=O)NC(c1nnc(n1C)SCC(=O)Nc1ccc(c(c1)Cl)F)CO
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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 C21H21ClFN5O4S MW 493.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClFN5O4S/c1-28-19(17(10-29)25-20(31)12-3-6-14(32-2)7-4-12)26-27-21(28)33-11-18(30)24-13-5-8-16(23)15(22)9-13/h3-9,17,29H,10-11H2,1-2H3,(H,24,30)(H,25,31)InChIKey
WNJXMGGERYRZRZ-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)F)Cl)C(CO)NC(=O)C3=CC=C(C=C3)OC
InChI=1SC21H21ClFN5O4Sc12819(17(1029)2520(31)123614(322)7412)262721(28)331118(30)24135816(23)15(22)913h391729H1011H212H3(H2430)(H2531)
MFCD05998988
N((1R)1(5((2((3CHLORO4FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)2HYDROXYETHYL)4METHOXYBENZAMIDE
N(1(5((2((3CHLORO4FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)2HYDROXYETHYL)4METHOXYBENZAMIDE
N(1(5((3CHLORO4FLUOROPHENYLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)2HYDROXYETHYL)4METHOXYBENZAMIDE
N(1(5(2(3CHLORO4FLUOROANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)2HYDROXYETHYL)4METHOXYBENZAMIDE
ZINC000002867128
ZINC000002867129
Check stock
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Check stock on Vitas-MAvailable files
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