Vitas-M small molecule compound

2-amino-6-cyclopropyl-5-(3-nitro-1H-1,2,4-triazol-1-yl)-4-phenyl-4H-pyran-3-carbonitrile

Catalog ID
STK760244
SMILES N#CC1=C(N)OC(=C(C1c1ccccc1)n1cnc(n1)[N+](=O)[O-])C1CC1

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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 C17H14N6O3 MW 350.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N6O3/c18-8-12-13(10-4-2-1-3-5-10)14(15(11-6-7-11)26-16(12)19)22-9-20-17(21-22)23(24)25/h1-5,9,11,13H,6-7,19H2
InChIKey
OEDYYQHGIJJMQT-UHFFFAOYSA-N
Synonyms

(4S)2AMINO6CYCLOPROPYL5(3NITRO1H124TRIAZOL1YL)4PHENYL4HPYRAN3CARBONITRILE
2AMINO6CYCLOPROPYL5(3NITRO124TRIAZOL1YL)4PHENYL4HPYRAN3CARBONITRILE
2amino6cyclopropyl5(3nitro1H124triazol1yl)4phenyl4Hpyran3carbonitrile
C1CC1C2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3)N4C=NC(=N4)(N+)(=O)(O)
InChI=1SC17H14N6O3c1881213(104213510)14(15(116711)2616(12)19)2292017(2122)23(24)25h1591113H6719H2
MFCD01572248
N#CC1=C(N)OC(=C(C1c1ccccc1)n1cnc(n1)(N+)(=O)(O))C1CC1
ZINC000001063379
ZINC000001063382

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Available files

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