Vitas-M small molecule compound
4-(1,3-dimethyl-2,4,6-trioxo-1,2,3,4,5,6,7,8,9,10-decahydropyrimido[4,5-b]quinolin-5-yl)benzonitrile
Catalog ID
STK981161
SMILES N#Cc1ccc(cc1)C1C2=C(CCCC2=O)Nc2c1c(=O)n(c(=O)n2C)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 C20H18N4O3 MW 362.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O3/c1-23-18-17(19(26)24(2)20(23)27)15(12-8-6-11(10-21)7-9-12)16-13(22-18)4-3-5-14(16)25/h6-9,15,22H,3-5H2,1-2H3InChIKey
VNWMQJMNPPVEAT-UHFFFAOYSA-NSynonyms
4(13dimethyl246trioxo12345678910decahydropyrimido(45b)quinolin5yl)benzonitrile
4(13dimethyl246trioxo78910tetrahydro5Hpyrimido(45b)quinolin5yl)benzonitrile
CN1C2=C(C(C3=C(N2)CCCC3=O)C4=CC=C(C=C4)C#N)C(=O)N(C1=O)C
InChI=1SC20H18N4O3c1231817(19(26)24(2)20(23)27)15(128611(1021)7912)1613(2218)43514(16)25h691522H35H212H3
MFCD03133202
ZINC000004279361
ZINC000004279362
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