Vitas-M small molecule compound
8-amino-5-(3-methoxyphenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Catalog ID
STK687799
SMILES N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccc(c1)OC)C(=O)CCC2)sc1c3C2CCN1CC2
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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 C27H25N5O2S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S/c1-34-16-5-2-4-15(12-16)20-17(13-28)25-30-24(29)23-21-14-8-10-31(11-9-14)26(21)35-27(23)32(25)18-6-3-7-19(33)22(18)20/h2,4-5,12,14,20H,3,6-11H2,1H3,(H2,29,30)InChIKey
FAKQXTSLBWIPCI-UHFFFAOYSA-NSynonyms
8amino5(3methoxyphenyl)4oxo13451011hexahydro2H9H912ethanopyrido(3245)thieno(3256)pyrimido(12a)quinoline6carbonitrile
COC1=CC=CC(=C1)C2C(=C3N=C(C4=C(N3C5=C2C(=O)CCC5)SC6=C4C7CCN6CC7)N)C#N
InChI=1SC27H25N5O2Sc1341652415(1216)2017(1328)253024(29)23211481031(11914)26(21)3527(23)32(25)1863719(33)22(18)20h245121420H3611H21H3(H22930)
MFCD07021797
ZINC000012371544
ZINC000012371545
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