Vitas-M small molecule compound
2-butyl-3-{[(E)-(4-ethoxyphenyl)methylidene]amino}-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STK782663
SMILES CCCCc1nc2c3c(COC)cc(nc3sc2c(=O)n1/N=C/c1ccc(cc1)OCC)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 C25H28N4O3S MW 464.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O3S/c1-5-7-8-20-28-22-21-18(15-31-4)13-16(3)27-24(21)33-23(22)25(30)29(20)26-14-17-9-11-19(12-10-17)32-6-2/h9-14H,5-8,15H2,1-4H3/b26-14+InChIKey
XARNCWZLAUSEDA-VULFUBBASA-NSynonyms
2butyl3(((E)(4ethoxyphenyl)methylidene)amino)9(methoxymethyl)7methylpyrido(3245)thieno(32d)pyrimidin4(3H)one
2butyl3((E)(4ethoxyphenyl)methylideneamino)9(methoxymethyl)7methylpyrido(12)thieno(34d)pyrimidin4one
CCCCC1=NC2=C(C(=O)N1N=CC3=CC=C(C=C3)OCC)SC4=C2C(=CC(=N4)C)COC
CCCCc1nc2c3c(COC)cc(nc3sc2c(=O)n1N=Cc1ccc(cc1)OCC)C
InChI=1SC25H28N4O3Sc15782028222118(15314)1316(3)2724(21)3323(22)25(30)29(20)26141791119(121017)3262h914H5815H214H3b2614+
MFCD06017974
ZINC000012410987
ZINC96602946
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