Vitas-M small molecule compound
4-butyl-3-ethoxy-2-(4-methylphenyl)-5-oxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile
Catalog ID
STL447393
SMILES CCCCN1C(=O)C(=NN(C1OCC)c1ccc(cc1)C)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 C17H22N4O2 MW 314.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O2/c1-4-6-11-20-16(22)15(12-18)19-21(17(20)23-5-2)14-9-7-13(3)8-10-14/h7-10,17H,4-6,11H2,1-3H3InChIKey
JLOKQJQFZDQNEZ-UHFFFAOYSA-NSynonyms
4butyl3ethoxy2(4methylphenyl)5oxo2345tetrahydro124triazine6carbonitrile
4BUTYL3ETHOXY2(4METHYLPHENYL)5OXO3H124TRIAZINE6CARBONITRILE
CCCCN1C(N(N=C(C1=O)C#N)C2=CC=C(C=C2)C)OCC
InChI=1SC17H22N4O2c146112016(22)15(1218)1921(17(20)2352)149713(3)81014h71017H4611H213H3
MFCD06244319
ZINC000003772046
ZINC000003772047
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