Vitas-M small molecule compound

(2Z)-N-(5-methyl-1,2-oxazol-3-yl)-3-(1-methyl-1H-pyrazol-4-yl)-2-(4-nitro-1H-pyrazol-1-yl)prop-2-enamide

Catalog ID
STL395054
SMILES Cn1ncc(c1)/C=C(\n1ncc(c1)[N+](=O)[O-])/C(=O)Nc1noc(c1)C

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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 C14H13N7O4 MW 343.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N7O4/c1-9-3-13(18-25-9)17-14(22)12(4-10-5-15-19(2)7-10)20-8-11(6-16-20)21(23)24/h3-8H,1-2H3,(H,17,18,22)/b12-4-
InChIKey
NQDZBCAHIZFFOF-QCDXTXTGSA-N
Synonyms
1005634-74-1
(2Z)N(5METHYL12OXAZOL3YL)3(1METHYL1HPYRAZOL4YL)2(4NITRO1HPYRAZOL1YL)PROP2ENAMIDE
(Z)N(5METHYL12OXAZOL3YL)3(1METHYLPYRAZOL4YL)2(4NITROPYRAZOL1YL)PROP2ENAMIDE
1005634741
CC1=CC(=NO1)NC(=O)C(=CC2=CN(N=C2)C)N3C=C(C=N3)(N+)(=O)(O)
Cn1ncc(c1)C=C(n1ncc(c1)(N+)(=O)(O))C(=O)Nc1noc(c1)C
InChI=1SC14H13N7O4c19313(18259)1714(22)12(41051519(2)710)20811(61620)21(23)24h38H12H3(H171822)b124
MFCD04050131
ZINC000017071635
ZINC17071635

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Available files

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