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-ethylphenyl)acetamide
Catalog ID
STK278749
SMILES CCc1ccccc1NC(=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 C22H22N6O2S2 MW 466.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2S2/c1-3-14-8-4-5-9-15(14)23-19(29)12-18-26-27-22(28(18)2)31-13-20(30)25-21-24-16-10-6-7-11-17(16)32-21/h4-11H,3,12-13H2,1-2H3,(H,23,29)(H,24,25,30)InChIKey
JWEXZZHHZZTLJD-UHFFFAOYSA-NSynonyms
2(5((2(13benzothiazol2ylamino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)N(2ethylphenyl)acetamide
2(5(2(13BENZOTHIAZOL2YLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(2ETHYLPHENYL)ACETAMIDE
2(5(BENZOTHIAZOL2YLCARBAMOYLMETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)N(2ETHYLPHENYL)ACETAMIDE
CCC1=CC=CC=C1NC(=O)CC2=NN=C(N2C)SCC(=O)NC3=NC4=CC=CC=C4S3
InChI=1SC22H22N6O2S2c1314845915(14)2319(29)1218262722(28(18)2)311320(30)2521241610671117(16)3221h411H31213H212H3(H2329)(H242530)
MFCD07790407
ZINC000009095896
ZINC09095896
ZINC9095896
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