Vitas-M small molecule compound
8-fluoro-3-{[(E)-(4-methylcyclohex-3-en-1-yl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Catalog ID
STL345973
SMILES CC1=CCC(CC1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)F
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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 C18H17FN4O MW 324.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17FN4O/c1-11-2-4-12(5-3-11)9-21-23-10-20-16-14-8-13(19)6-7-15(14)22-17(16)18(23)24/h2,6-10,12,22H,3-5H2,1H3/b21-9+InChIKey
WSEGYHWRNOBNEM-ZVBGSRNCSA-NSynonyms
(SE)8fluoro3(((4methylcyclohex3en1yl)methylene)amino)3Hpyrimido(54b)indol4(5H)one
8fluoro3(((E)(4methylcyclohex3en1yl)methylidene)amino)35dihydro4Hpyrimido(54b)indol4one
8fluoro3((E)(4methylcyclohex3en1yl)methylideneamino)5Hpyrimido(54b)indol4one
CC1=CC(C@H)(CC1)C=Nn1cnc2c(c1=O)(nH)c1c2cc(cc1)F
CC1=CCC(CC1)C=Nn1cnc2c(c1=O)(nH)c1c2cc(cc1)F
CC1=CCC(CC1)C=NN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)F
InChI=1SC18H17FN4Oc1112412(5311)9212310201614813(19)6715(14)2217(16)18(23)24h26101222H35H21H3b219+
MFCD28032188
ZINC000005253947
ZINC000005903521
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