Vitas-M small molecule compound
(1Z)-8-ethyl-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
STL510615
SMILES CCc1cc2C(=CC(N3c2c(c1)/C(=C\1/SC(=S)NC1=O)/C3=O)(C)C)CSc1nnc(s1)C
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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 C22H20N4O2S4 MW 500.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O2S4/c1-5-11-6-13-12(9-30-21-25-24-10(2)31-21)8-22(3,4)26-16(13)14(7-11)15(19(26)28)17-18(27)23-20(29)32-17/h6-8H,5,9H2,1-4H3,(H,23,27,29)/b17-15-InChIKey
IKFVTPYYYXWEBK-ICFOKQHNSA-NSynonyms
(1Z)8ethyl44dimethyl6(((5methyl134thiadiazol2yl)sulfanyl)methyl)1(4oxo2thioxo13thiazolidin5ylidene)4Hpyrrolo(321ij)quinolin2(1H)one
(5~(Z))5(6ethyl1111dimethyl9((5methyl134thiadiazol2yl)sulfanylmethyl)2oxo1azatricyclo(6310^(412))dodeca468(12)9tetraen3ylidene)2sulfanylidene13thiazolidin4one
134717258
InChI=1SC22H20N4O2S4c151161312(93021252410(2)3121)822(34)2616(13)14(711)15(19(26)28)1718(27)2320(29)3217h68H59H214H3(H232729)b1715
MFCD31711564
ZINC001554503143
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