Vitas-M small molecule compound
4-benzyl-3-ethoxy-2-(4-nitrophenyl)-5-oxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile
Catalog ID
STL447385
SMILES CCOC1N(N=C(C(=O)N1Cc1ccccc1)C#N)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 C19H17N5O4 MW 379.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O4/c1-2-28-19-22(13-14-6-4-3-5-7-14)18(25)17(12-20)21-23(19)15-8-10-16(11-9-15)24(26)27/h3-11,19H,2,13H2,1H3InChIKey
KAVIYWFXSBYOBB-UHFFFAOYSA-NSynonyms
4benzyl3ethoxy2(4nitrophenyl)5oxo2345tetrahydro124triazine6carbonitrile
4BENZYL3ETHOXY2(4NITROPHENYL)5OXO3H124TRIAZINE6CARBONITRILE
CCOC1N(C(=O)C(=NN1C2=CC=C(C=C2)(N+)(=O)(O))C#N)CC3=CC=CC=C3
CCOC1N(N=C(C(=O)N1Cc1ccccc1)C#N)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H17N5O4c12281922(13146435714)18(25)17(1220)2123(19)1581016(11915)24(26)27h31119H213H21H3
MFCD06244311
ZINC000005243253
ZINC000005243255
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