Vitas-M small molecule compound
(2Z)-5-amino-7-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Catalog ID
STL382078
SMILES N#CC1=c2s/c(=C\c3ccc4c(c3)OCO4)/c(=O)n2C(=C(C1c1ccc2c(c1)OCO2)C#N)N
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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 C24H14N4O5S MW 470.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H14N4O5S/c25-8-14-21(13-2-4-17-19(7-13)33-11-31-17)15(9-26)24-28(22(14)27)23(29)20(34-24)6-12-1-3-16-18(5-12)32-10-30-16/h1-7,21H,10-11,27H2/b20-6-InChIKey
MVNCAZXPJWYDBP-IOXNKQMXSA-NSynonyms
(2Z)5amino7(13benzodioxol5yl)2(13benzodioxol5ylmethylidene)3oxo23dihydro7H(13)thiazolo(32a)pyridine68dicarbonitrile
(2Z)5AMINO7(13BENZODIOXOL5YL)2(13BENZODIOXOL5YLMETHYLIDENE)3OXO7H(13)THIAZOLO(32A)PYRIDINE68DICARBONITRILE
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N4C(=C(C(C(=C4S3)C#N)C5=CC6=C(C=C5)OCO6)C#N)N
InChI=1SC24H14N4O5Sc2581421(13241719(713)33113117)15(926)2428(22(14)27)23(29)20(3424)612131618(512)32103016h1721H101127H2b206
MFCD01450981
N#CC1=c2sc(=Cc3ccc4c(c3)OCO4)c(=O)n2C(=C(C1c1ccc2c(c1)OCO2)C#N)N
ZINC000002920431
ZINC000002920435
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