Vitas-M small molecule compound
4-methoxy-N-{[4-methyl-5-({2-[(4-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Catalog ID
STK297410
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1C)SCC(=O)Nc1nc2c(s1)cccc2C
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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 C22H22N6O3S2 MW 482.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O3S2/c1-13-5-4-6-16-19(13)25-21(33-16)24-18(29)12-32-22-27-26-17(28(22)2)11-23-20(30)14-7-9-15(31-3)10-8-14/h4-10H,11-12H2,1-3H3,(H,23,30)(H,24,25,29)InChIKey
ITVACPASGGMILD-UHFFFAOYSA-NSynonyms
4methoxyN((4methyl5((2((4methyl13benzothiazol2yl)amino)2oxoethyl)sulfanyl)4H124triazol3yl)methyl)benzamide
4methoxyN((4methyl5(2((4methyl13benzothiazol2yl)amino)2oxoethyl)sulfanyl124triazol3yl)methyl)benzamide
4METHOXYN(4METHYL5((4METHYLBENZOTHIAZOL2YLCARBAMOYL)METHYLSULFANYL)4H(124)TRIAZOL3YLMETHYL)BENZAMIDE
CC1=C2C(=CC=C1)SC(=N2)NC(=O)CSC3=NN=C(N3C)CNC(=O)C4=CC=C(C=C4)OC
InChI=1SC22H22N6O3S2c1135461619(13)2521(3316)2418(29)123222272617(28(22)2)112320(30)147915(313)10814h410H1112H213H3(H2330)(H242529)
MFCD09960981
ZINC000013956405
ZINC13956405
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