Vitas-M small molecule compound
8-fluoro-3-({(E)-[6-methyl-4-(4-methylpent-3-en-1-yl)cyclohex-3-en-1-yl]methylidene}amino)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Catalog ID
STK530536
SMILES CC(=CCCC1=CCC(C(C1)C)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)F)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 C24H27FN4O2 MW 422.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27FN4O2/c1-14(2)5-4-6-16-7-8-17(15(3)11-16)13-26-29-23(30)22-21(28-24(29)31)19-12-18(25)9-10-20(19)27-22/h5,7,9-10,12-13,15,17,27H,4,6,8,11H2,1-3H3,(H,28,31)/b26-13+InChIKey
PTCHRNVRDYQMRO-LGJNPRDNSA-NSynonyms
(E)8fluoro3(((6methyl4(4methylpent3en1yl)cyclohex3en1yl)methylene)amino)1Hpyrimido(54b)indole24(3H5H)dione
8fluoro3(((E)(6methyl4(4methylpent3en1yl)cyclohex3en1yl)methylidene)amino)1Hpyrimido(54b)indole24(3H5H)dione
8fluoro3((E)(6methyl4(4methylpent3enyl)cyclohex3en1yl)methylideneamino)15dihydropyrimido(54b)indole24dione
CC(=CCCC1=CCC(C(C1)C)C=Nn1c(=O)(nH)c2c(c1=O)(nH)c1c2cc(cc1)F)C
CC1CC(=CCC1C=NN2C(=O)C3=C(C4=C(N3)C=CC(=C4)F)NC2=O)CCC=C(C)C
InChI=1SC24H27FN4O2c114(2)546167817(15(3)1116)13262923(30)2221(2824(29)31)191218(25)91020(19)2722h579101213151727H46811H213H3(H2831)b2613+
MFCD02237595
ZINC000004816260
ZINC000004816264
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