Vitas-M small molecule compound
2-butyl-9-(methoxymethyl)-7-methyl-3-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STK782679
SMILES CCCCc1nc2c3c(COC)cc(nc3sc2c(=O)n1CCC12CC3CC(C2)CC(C1)C3)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 C28H37N3O2S MW 479.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37N3O2S/c1-4-5-6-22-30-24-23-21(16-33-3)9-17(2)29-26(23)34-25(24)27(32)31(22)8-7-28-13-18-10-19(14-28)12-20(11-18)15-28/h9,18-20H,4-8,10-16H2,1-3H3InChIKey
XYRUHLMJHPPAHX-UHFFFAOYSA-NSynonyms
2butyl9(methoxymethyl)7methyl3(2(tricyclo(3311~37~)dec1yl)ethyl)pyrido(3245)thieno(32d)pyrimidin4(3H)one
3(2(1adamantyl)ethyl)2butyl9(methoxymethyl)7methylpyrido(12)thieno(34d)pyrimidin4one
CCCCC1=NC2=C(C(=O)N1CCC34CC5CC(C3)CC(C5)C4)SC6=C2C(=CC(=N6)C)COC
InChI=1SC28H37N3O2Sc14562230242321(16333)917(2)2926(23)3425(24)27(32)31(22)872813181019(1428)1220(1118)1528h91820H481016H213H3
MFCD06018000
ZINC000012410991
ZINC12410991
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