Vitas-M small molecule compound

(2E)-3-(1H-indazol-6-ylamino)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Catalog ID
STK536120
SMILES N#C/C(=C\Nc1ccc2c(c1)[nH]nc2)/c1scc(n1)c1ccc(cc1)[N+](=O)[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 C19H12N6O2S MW 388.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N6O2S/c20-8-14(9-21-15-4-1-13-10-22-24-17(13)7-15)19-23-18(11-28-19)12-2-5-16(6-3-12)25(26)27/h1-7,9-11,21H,(H,22,24)/b14-9+
InChIKey
KPIAMORPPUHSAL-NTEUORMPSA-N
Synonyms

(2E)3(1Hindazol6ylamino)2(4(4nitrophenyl)13thiazol2yl)prop2enenitrile
(E)3((1Hindazol6yl)amino)2(4(4nitrophenyl)thiazol2yl)acrylonitrile
(E)3(1HINDAZOL6YLAMINO)2(4(4NITROPHENYL)13THIAZOL2YL)PROP2ENENITRILE
C1=CC(=CC=C1C2=CSC(=N2)C(=CNC3=CC4=C(C=C3)C=NN4)C#N)(N+)(=O)(O)
InChI=1SC19H12N6O2Sc20814(92115411310222417(13)715)192318(112819)122516(6312)25(26)27h1791121H(H2224)b149+
MFCD02984295
N#CC(=CNc1ccc2c(c1)(nH)nc2)c1scc(n1)c1ccc(cc1)(N+)(=O)(O)
ZINC000004333917
ZINC04333917
ZINC4333917

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Available files

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