Vitas-M small molecule compound

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

Catalog ID
STK790830
SMILES N#CC1=C(N)n2c(=O)/c(=C/c3ccccc3[N+](=O)[O-])/sc2=C(C1c1ccccc1[N+](=O)[O-])C#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/c23-10-14-19(13-6-2-4-8-17(13)28(32)33)15(11-24)22-26(20(14)25)21(29)18(34-22)9-12-5-1-3-7-16(12)27(30)31/h1-9,19H,25H2/b18-9-
InChIKey
MWOHUPUTVRGPOP-NVMNQCDNSA-N
Synonyms
370077-48-8
(2Z)5amino2(2nitrobenzylidene)7(2nitrophenyl)3oxo23dihydro7H(13)thiazolo(32a)pyridine68dicarbonitrile
(2Z)5AMINO7(2NITROPHENYL)2((2NITROPHENYL)METHYLIDENE)3OXO7H(13)THIAZOLO(32A)PYRIDINE68DICARBONITRILE
(Z)5amino2(2nitrobenzylidene)7(2nitrophenyl)3oxo37dihydro2Hthiazolo(32a)pyridine68dicarbonitrile
370077488
C1=CC=C(C(=C1)C=C2C(=O)N3C(=C(C(C(=C3S2)C#N)C4=CC=CC=C4(N+)(=O)(O))C#N)N)(N+)(=O)(O)
InChI=1SC22H12N6O5Sc23101419(13624817(13)28(32)33)15(1124)2226(20(14)25)21(29)18(3422)912513716(12)27(30)31h1919H25H2b189
MFCD00848546
N#CC1=C(N)n2c(=O)c(=Cc3ccccc3(N+)(=O)(O))sc2=C(C1c1ccccc1(N+)(=O)(O))C#N
ZINC000001786458
ZINC000001786463

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Available files

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