Vitas-M small molecule compound
2-(5-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-N-(4-fluorophenyl)acetamide
Catalog ID
STK221949
SMILES Fc1ccc(cc1)NC(=O)Cc1nnc(n1C)SCC(=O)Nc1nc2c(s1)cccc2
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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 C20H17FN6O2S2 MW 456.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17FN6O2S2/c1-27-16(10-17(28)22-13-8-6-12(21)7-9-13)25-26-20(27)30-11-18(29)24-19-23-14-4-2-3-5-15(14)31-19/h2-9H,10-11H2,1H3,(H,22,28)(H,23,24,29)InChIKey
OCAUFIVGLCTJAM-UHFFFAOYSA-NSynonyms
2(5((2(13benzothiazol2ylamino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)N(4fluorophenyl)acetamide
2(5(2(13BENZOTHIAZOL2YLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(4FLUOROPHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=NC3=CC=CC=C3S2)CC(=O)NC4=CC=C(C=C4)F
InChI=1SC20H17FN6O2S2c12716(1017(28)22138612(21)7913)252620(27)301118(29)24192314423515(14)3119h29H1011H21H3(H2228)(H232429)
MFCD07399353
ZINC000009303122
ZINC09303122
ZINC9303122
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