Vitas-M small molecule compound
3,4-dichloro-N-[2-(5-{[2-(4-cyanophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK245855
SMILES N#Cc1ccc(cc1)C(=O)CSc1nnc(n1CC)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 C22H19Cl2N5O2S MW 488.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19Cl2N5O2S/c1-2-29-20(9-10-26-21(31)16-7-8-17(23)18(24)11-16)27-28-22(29)32-13-19(30)15-5-3-14(12-25)4-6-15/h3-8,11H,2,9-10,13H2,1H3,(H,26,31)InChIKey
ZODYMOGOWYUQCO-UHFFFAOYSA-NSynonyms
34DICHLORON(2(5((2(4CYANOPHENYL)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
34dichloroN(2(5(2(4cyanophenyl)2oxoethyl)sulfanyl4ethyl124triazol3yl)ethyl)benzamide
34DICHLORON(2(5(2(4CYANOPHENYL)2OXOETHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC22H19Cl2N5O2Sc122920(9102621(31)167817(23)18(24)1116)272822(29)321319(30)155314(1225)4615h3811H291013H21H3(H2631)
MFCD08670610
ZINC000009328280
ZINC09328280
ZINC9328280
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