Vitas-M small molecule compound
3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-8,8-dimethyl-5-phenyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one
Catalog ID
STL041069
SMILES COc1ccc(cc1OC)CCn1cnc2c(c1=N)C(c1ccccc1)C1=C(O2)CC(CC1=O)(C)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 C29H31N3O4 MW 485.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O4/c1-29(2)15-20(33)25-23(16-29)36-28-26(24(25)19-8-6-5-7-9-19)27(30)32(17-31-28)13-12-18-10-11-21(34-3)22(14-18)35-4/h5-11,14,17,24,30H,12-13,15-16H2,1-4H3/b30-27+InChIKey
FAEBHHJVRHAZPS-KDJFERLWSA-NSynonyms
3(2(34dimethoxyphenyl)ethyl)4imino88dimethyl5phenyl345789hexahydro6Hchromeno(23d)pyrimidin6one
3(34dimethoxyphenethyl)4imino88dimethyl5phenyl5789tetrahydro3Hchromeno(23d)pyrimidin6(4H)one
MFCD04195707
ZINC000101170851
ZINC000101170854
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