Vitas-M small molecule compound
ethyl {5-[(2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}butanoyl)amino]-1,3,4-thiadiazol-2-yl}acetate
Catalog ID
STK771091
SMILES CCOC(=O)Cc1nnc(s1)NC(=O)C(Sc1nnc2c(n1)n(C(C)C)c1c2cccc1)CC
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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 C22H25N7O3S2 MW 499.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N7O3S2/c1-5-15(20(31)24-22-27-25-16(34-22)11-17(30)32-6-2)33-21-23-19-18(26-28-21)13-9-7-8-10-14(13)29(19)12(3)4/h7-10,12,15H,5-6,11H2,1-4H3,(H,24,27,31)InChIKey
GUAFVQQHNHWUMD-UHFFFAOYSA-NSynonyms
682759-56-4682759564
CCC(C(=O)NC1=NN=C(S1)CC(=O)OCC)SC2=NC3=C(C4=CC=CC=C4N3C(C)C)N=N2
ethyl(5((2((5(propan2yl)5H(124)triazino(56b)indol3yl)sulfanyl)butanoyl)amino)134thiadiazol2yl)acetate
ETHYL2(5(2((5PROPAN2YL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)BUTANOYLAMINO)134THIADIAZOL2YL)ACETATE
InChI=1SC22H25N7O3S2c1515(20(31)2422272516(3422)1117(30)3262)3321231918(262821)139781014(13)29(19)12(3)4h7101215H5611H214H3(H242731)
MFCD03766967
ZINC000002746381
ZINC000002746382
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