Vitas-M small molecule compound

(2Z)-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
STL324383
SMILES N#CC1=Cn2c(=C(C1c1ccc3c(c1)OCO3)C#N)s/c(=C\c1ccc3c(c1)OCO3)/c2=O

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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 C24H13N3O5S MW 455.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H13N3O5S/c25-8-15-10-27-23(28)21(6-13-1-3-17-19(5-13)31-11-29-17)33-24(27)16(9-26)22(15)14-2-4-18-20(7-14)32-12-30-18/h1-7,10,22H,11-12H2/b21-6-
InChIKey
SVWHQJDQJCNCAK-MPUCSWFWSA-N
Synonyms
370840-79-2
(2Z)7(13benzodioxol5yl)2(13benzodioxol5ylmethylidene)3oxo23dihydro7H(13)thiazolo(32a)pyridine68dicarbonitrile
(2Z)7(13BENZODIOXOL5YL)2(13BENZODIOXOL5YLMETHYLIDENE)3OXO7H(13)THIAZOLO(32A)PYRIDINE68DICARBONITRILE
(Z)7(benzo(d)(13)dioxol5yl)2(benzo(d)(13)dioxol5ylmethylene)3oxo37dihydro2Hthiazolo(32a)pyridine68dicarbonitrile
370840792
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
InChI=1SC24H13N3O5Sc25815102723(28)21(613131719(513)31112917)3324(27)16(926)22(15)14241820(714)32123018h171022H1112H2b216
MFCD01558316
N#CC1=Cn2c(=C(C1c1ccc3c(c1)OCO3)C#N)sc(=Cc1ccc3c(c1)OCO3)c2=O
ZINC000002230063
ZINC000002230066

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Available files

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