Vitas-M small molecule compound
4-butyl-2-(4-chlorophenyl)-3-ethoxy-5-oxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile
Catalog ID
STL447392
SMILES CCCCN1C(=O)C(=NN(C1OCC)c1ccc(cc1)Cl)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 C16H19ClN4O2 MW 334.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19ClN4O2/c1-3-5-10-20-15(22)14(11-18)19-21(16(20)23-4-2)13-8-6-12(17)7-9-13/h6-9,16H,3-5,10H2,1-2H3InChIKey
RTUUAUSAOYYJIK-UHFFFAOYSA-NSynonyms
4butyl2(4chlorophenyl)3ethoxy5oxo2345tetrahydro124triazine6carbonitrile
4BUTYL2(4CHLOROPHENYL)3ETHOXY5OXO3H124TRIAZINE6CARBONITRILE
CCCCN1C(N(N=C(C1=O)C#N)C2=CC=C(C=C2)Cl)OCC
InChI=1SC16H19ClN4O2c135102015(22)14(1118)1921(16(20)2342)138612(17)7913h6916H3510H212H3
MFCD06244318
ZINC000003772044
ZINC000003772045
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