Vitas-M small molecule compound
3,4-dichloro-N-[2-(5-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK235954
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1C)CCNC(=O)c1ccc(c(c1)Cl)Cl
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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 C21H20Cl2N4O3S MW 479.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20Cl2N4O3S/c1-27-19(9-10-24-20(29)14-5-8-16(22)17(23)11-14)25-26-21(27)31-12-18(28)13-3-6-15(30-2)7-4-13/h3-8,11H,9-10,12H2,1-2H3,(H,24,29)InChIKey
YNPNZFQJSLHBNJ-UHFFFAOYSA-NSynonyms
34DICHLORON(2(5((2(4METHOXYPHENYL)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
34DICHLORON(2(5(2(4METHOXYPHENYL)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)OC)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC21H20Cl2N4O3Sc12719(9102420(29)145816(22)17(23)1114)252621(27)311218(28)133615(302)7413h3811H91012H212H3(H2429)
MFCD06007395
ZINC000001066710
ZINC01066710
ZINC1066710
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