Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)amino]-7-methyl-3-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK704721
SMILES Cc1ccc2n(c1)c(=O)c(c(n2)NCc1ccc2c(c1)OCO2)/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)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 C29H24N4O4S2 MW 556.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4O4S2/c1-17-8-11-25-31-26(30-14-19-9-10-22-23(12-19)37-16-36-22)21(27(34)32(25)15-17)13-24-28(35)33(29(38)39-24)18(2)20-6-4-3-5-7-20/h3-13,15,18,30H,14,16H2,1-2H3/b24-13-InChIKey
IZKWIEQWHRXZDO-CFRMEGHHSA-NSynonyms
(5Z)5((2(13BENZODIOXOL5YLMETHYLAMINO)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
2((13benzodioxol5ylmethyl)amino)7methyl3((Z)(4oxo3(1phenylethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C(C)C4=CC=CC=C4)NCC5=CC6=C(C=C5)OCO6)C=C1
Cc1ccc2n(c1)c(=O)c(c(n2)NCc1ccc2c(c1)OCO2)C=C1SC(=S)N(C1=O)C(c1ccccc1)C
InChI=1SC29H24N4O4S2c117811253126(3014199102223(1219)37163622)21(27(34)32(25)1517)132428(35)33(29(38)3924)18(2)206435720h313151830H1416H212H3b2413
MFCD03212835
ZINC000100762850
ZINC000100762854
Check stock
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Check stock on Vitas-MAvailable files
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