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-(2-methoxyphenyl)acetamide
Catalog ID
STK246131
SMILES COc1ccccc1NC(=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 C21H20N6O3S2 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3S2/c1-27-17(11-18(28)22-13-7-3-5-9-15(13)30-2)25-26-21(27)31-12-19(29)24-20-23-14-8-4-6-10-16(14)32-20/h3-10H,11-12H2,1-2H3,(H,22,28)(H,23,24,29)InChIKey
ZOSVBXYNDBMJBB-UHFFFAOYSA-NSynonyms
2(5((2(13benzothiazol2ylamino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)N(2methoxyphenyl)acetamide
2(5(2(13benzothiazol2ylamino)2oxoethyl)sulfanyl4methyl124triazol3yl)N(2methoxyphenyl)acetamide
2(5(BENZOTHIAZOL2YLCARBAMOYLMETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)N(2METHOXYPHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=NC3=CC=CC=C3S2)CC(=O)NC4=CC=CC=C4OC
InChI=1SC21H20N6O3S2c12717(1118(28)2213735915(13)302)252621(27)311219(29)242023148461016(14)3220h310H1112H212H3(H2228)(H232429)
MFCD08683750
ZINC000009667602
ZINC09667602
ZINC9667602
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