Vitas-M small molecule compound

2-ethyl-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
STK782680
SMILES COCc1cc(C)nc2c1c1nc(CC)n(c(=O)c1s2)CCC12CC3CC(C2)CC(C1)C3

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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 C26H33N3O2S MW 451.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O2S/c1-4-20-28-22-21-19(14-31-3)7-15(2)27-24(21)32-23(22)25(30)29(20)6-5-26-11-16-8-17(12-26)10-18(9-16)13-26/h7,16-18H,4-6,8-14H2,1-3H3
InChIKey
JTFCOFQARQESNY-UHFFFAOYSA-N
Synonyms

2ethyl9(methoxymethyl)7methyl3(2(tricyclo(3311~37~)dec1yl)ethyl)pyrido(3245)thieno(32d)pyrimidin4(3H)one
3(2(1adamantyl)ethyl)2ethyl9(methoxymethyl)7methylpyrido(12)thieno(34d)pyrimidin4one
CCC1=NC2=C(C(=O)N1CCC34CC5CC(C3)CC(C5)C4)SC6=C2C(=CC(=N6)C)COC
InChI=1SC26H33N3O2Sc142028222119(14313)715(2)2724(21)3223(22)25(30)29(20)65261116817(1226)1018(916)1326h71618H46814H213H3
MFCD06018001
ZINC000012413595
ZINC12413595

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Available files

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