Vitas-M small molecule compound
4-chloro-N-[2-(5-{[2-(4-cyanophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK267123
SMILES N#Cc1ccc(cc1)C(=O)CSc1nnc(n1C)CCNC(=O)c1ccc(cc1)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 C21H18ClN5O2S MW 439.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O2S/c1-27-19(10-11-24-20(29)16-6-8-17(22)9-7-16)25-26-21(27)30-13-18(28)15-4-2-14(12-23)3-5-15/h2-9H,10-11,13H2,1H3,(H,24,29)InChIKey
VJBFTEWLYKPIQH-UHFFFAOYSA-NSynonyms
4CHLORON(2(5((2(4CYANOPHENYL)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4chloroN(2(5(2(4cyanophenyl)2oxoethyl)sulfanyl4methyl124triazol3yl)ethyl)benzamide
4CHLORON(2(5(2(4CYANOPHENYL)2OXOETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)ETHYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)CCNC(=O)C3=CC=C(C=C3)Cl
InChI=1SC21H18ClN5O2Sc12719(10112420(29)166817(22)9716)252621(27)301318(28)154214(1223)3515h29H101113H21H3(H2429)
MFCD09267772
ZINC000009582654
ZINC09582654
ZINC9582654
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