Vitas-M small molecule compound
(1Z)-4,4-dimethyl-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-1-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Catalog ID
STL510617
SMILES S=C1NC(=O)/C(=C\2/C(=O)N3c4c2cccc4C(=CC3(C)C)CSc2nnc(s2)C)/S1
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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 C20H16N4O2S4 MW 472.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O2S4/c1-9-22-23-19(29-9)28-8-10-7-20(2,3)24-14-11(10)5-4-6-12(14)13(17(24)26)15-16(25)21-18(27)30-15/h4-7H,8H2,1-3H3,(H,21,25,27)/b15-13-InChIKey
XIIYQMDCEJZADK-SQFISAMPSA-NSynonyms
(1Z)44dimethyl6(((5methyl134thiadiazol2yl)sulfanyl)methyl)1(4oxo2thioxo13thiazolidin5ylidene)4Hpyrrolo(321ij)quinolin2(1H)one
(5~(Z))5(1111dimethyl9((5methyl134thiadiazol2yl)sulfanylmethyl)2oxo1azatricyclo(6310^(412))dodeca468(12)9tetraen3ylidene)2sulfanylidene13thiazolidin4one
134717260
InChI=1SC20H16N4O2S4c19222319(299)28810720(23)241411(10)54612(14)13(17(24)26)1516(25)2118(27)3015h47H8H213H3(H212527)b1513
MFCD31711566
ZINC001554503297
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