Vitas-M small molecule compound
8-amino-4-oxo-5-phenyl-1,3,4,5,10,11,12,13-octahydro-2H,9H-cyclohepta[4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Catalog ID
STK761050
SMILES N#CC1=c2nc(N)c3c(n2C2=C(C1c1ccccc1)C(=O)CCC2)sc1c3CCCCC1
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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 C26H24N4OS MW 440.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4OS/c27-14-17-21(15-8-3-1-4-9-15)23-18(11-7-12-19(23)31)30-25(17)29-24(28)22-16-10-5-2-6-13-20(16)32-26(22)30/h1,3-4,8-9,21H,2,5-7,10-13H2,(H2,28,29)InChIKey
HONILTXLATVKTO-UHFFFAOYSA-NSynonyms
8amino4oxo5phenyl134510111213octahydro2H9Hcyclohepta(45)thieno(3256)pyrimido(12a)quinoline6carbonitrile
C1CCC2=C(CC1)SC3=C2C(=NC4=C(C(C5=C(N43)CCCC5=O)C6=CC=CC=C6)C#N)N
InChI=1SC26H24N4OSc27141721(158314915)2318(1171219(23)31)3025(17)2924(28)2216105261320(16)3226(22)30h1348921H2571013H2(H22829)
MFCD01820464
ZINC000000708331
ZINC000000708332
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