Vitas-M small molecule compound

(2Z)-5-amino-2-(3-nitrobenzylidene)-7-(3-nitrophenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile

Catalog ID
STK790832
SMILES N#CC1=c2s/c(=C\c3cccc(c3)[N+](=O)[O-])/c(=O)n2C(=C(C1c1cccc(c1)[N+](=O)[O-])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 C22H12N6O5S MW 472.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12N6O5S/c23-10-16-19(13-4-2-6-15(9-13)28(32)33)17(11-24)22-26(20(16)25)21(29)18(34-22)8-12-3-1-5-14(7-12)27(30)31/h1-9,19H,25H2/b18-8-
InChIKey
HRPMQURERTYCRG-LSCVHKIXSA-N
Synonyms
75052-62-9
(2Z)5amino2(3nitrobenzylidene)7(3nitrophenyl)3oxo23dihydro7H(13)thiazolo(32a)pyridine68dicarbonitrile
(2Z)5AMINO7(3NITROPHENYL)2((3NITROPHENYL)METHYLIDENE)3OXO7H(13)THIAZOLO(32A)PYRIDINE68DICARBONITRILE
(Z)5amino2(3nitrobenzylidene)7(3nitrophenyl)3oxo37dihydro2Hthiazolo(32a)pyridine68dicarbonitrile
75052629
C1=CC(=CC(=C1)(N+)(=O)(O))C=C2C(=O)N3C(=C(C(C(=C3S2)C#N)C4=CC(=CC=C4)(N+)(=O)(O))C#N)N
InChI=1SC22H12N6O5Sc23101619(1342615(913)28(32)33)17(1124)2226(20(16)25)21(29)18(3422)81231514(712)27(30)31h1919H25H2b188
MFCD01451530
N#CC1=c2sc(=Cc3cccc(c3)(N+)(=O)(O))c(=O)n2C(=C(C1c1cccc(c1)(N+)(=O)(O))C#N)N
ZINC000001762787
ZINC000001762789

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Available files

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