Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)amino]-3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK819548
SMILES S=C1S/C(=C\c2c(NCc3ccc4c(c3)OCO4)nc3n(c2=O)cccc3)/C(=O)N1Cc1ccccc1
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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 C27H20N4O4S2 MW 528.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N4O4S2/c32-25-19(13-22-26(33)31(27(36)37-22)15-17-6-2-1-3-7-17)24(29-23-8-4-5-11-30(23)25)28-14-18-9-10-20-21(12-18)35-16-34-20/h1-13,28H,14-16H2/b22-13-InChIKey
CIWFEGGCSIIRGL-XKZIYDEJSA-NSynonyms
(5Z)5((2(13benzodioxol5ylmethylamino)4oxopyrido(12a)pyrimidin3yl)methylidene)3benzyl2sulfanylidene13thiazolidin4one
2((13benzodioxol5ylmethyl)amino)3((Z)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=O)N4C=CC=CC4=N3)C=C5C(=O)N(C(=S)S5)CC6=CC=CC=C6
InChI=1SC27H20N4O4S2c322519(132226(33)31(27(36)3722)15176213717)24(29238451130(23)25)2814189102021(1218)35163420h11328H1416H2b2213
MFCD03212795
S=C1SC(=Cc2c(NCc3ccc4c(c3)OCO4)nc3n(c2=O)cccc3)C(=O)N1Cc1ccccc1
ZINC000100762763
ZINC100762763
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