Vitas-M small molecule compound
1-(4-ethoxy-2-nitrophenyl)-10-methyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Catalog ID
STK908256
SMILES CCOc1ccc(c(c1)[N+](=O)[O-])n1c(=O)c(C#N)cc2c1nc1c(C)cccn1c2=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 C21H15N5O5 MW 417.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N5O5/c1-3-31-14-6-7-16(17(10-14)26(29)30)25-19-15(9-13(11-22)20(25)27)21(28)24-8-4-5-12(2)18(24)23-19/h4-10H,3H2,1-2H3InChIKey
WPLMQGLFNGTUFM-UHFFFAOYSA-NSynonyms
880397-06-81(4ethoxy2nitrophenyl)10methyl25dioxo15dihydro2Hdipyrido(12a23d)pyrimidine3carbonitrile
1(4ethoxy2nitrophenyl)10methyl25dioxodipyrido(34c12f)pyrimidine3carbonitrile
880397068
CCOC1=CC(=C(C=C1)N2C3=C(C=C(C2=O)C#N)C(=O)N4C=CC=C(C4=N3)C)(N+)(=O)(O)
CCOc1ccc(c(c1)(N+)(=O)(O))n1c(=O)c(C#N)cc2c1nc1c(C)cccn1c2=O
InChI=1SC21H15N5O5c1331146716(17(1014)26(29)30)251915(913(1122)20(25)27)21(28)2484512(2)18(24)2319h410H3H212H3
MFCD06647724
ZINC000016752517
ZINC16752517
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