Vitas-M small molecule compound

2-(benzylsulfanyl)-8,8-dimethyl-3-phenyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one

Catalog ID
STK042600
SMILES O=c1c2cc3COC(Cc3nc2nc(n1c1ccccc1)SCc1ccccc1)(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 C25H23N3O2S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O2S/c1-25(2)14-21-18(15-30-25)13-20-22(26-21)27-24(31-16-17-9-5-3-6-10-17)28(23(20)29)19-11-7-4-8-12-19/h3-13H,14-16H2,1-2H3
InChIKey
JZBASUXBJNEBPQ-UHFFFAOYSA-N
Synonyms
353762-69-3
2(benzylsulfanyl)88dimethyl3phenyl3689tetrahydro4Hpyrano(3456)pyrido(23d)pyrimidin4one
2(benzylthio)88dimethyl3phenyl89dihydro3Hpyrano(3456)pyrido(23d)pyrimidin4(6H)one
2benzylsulfanyl88dimethyl3phenyl69dihydropyrano(34)pyrido(35b)pyrimidin4one
353762693
CC1(CC2=C(CO1)C=C3C(=N2)N=C(N(C3=O)C4=CC=CC=C4)SCC5=CC=CC=C5)C
InChI=1SC25H23N3O2Sc125(2)142118(153025)132022(2621)2724(31161795361017)28(23(20)29)19117481219h313H1416H212H3
MFCD01562332
O=c1c2cc3COC(Cc3nc2nc(n1c1ccccc1)SCc1ccccc1)(C)C
STK042600
ZINC000002266008
ZINC02266008
ZINC2266008

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Available files

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