Vitas-M small molecule compound

N-butyl-N-ethyl-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine

Catalog ID
STK532619
SMILES CCCCN(c1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C)CC

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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 C21H28N4OS MW 384.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4OS/c1-6-8-9-25(7-2)19-18-17(22-12-23-19)16-14-10-21(4,5)26-11-15(14)13(3)24-20(16)27-18/h12H,6-11H2,1-5H3
InChIKey
XSBLCOHVMKNGDS-UHFFFAOYSA-N
Synonyms

CCCCN(CC)C1=NC=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)C
InChI=1SC21H28N4OSc168925(72)191817(22122319)16141021(45)261115(14)13(3)2420(16)2718h12H611H215H3
NbutylNethyl225trimethyl14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8amine
NbutylNethyl225trimethyl24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8amine
ZINC000002292933
ZINC02292933
ZINC2292933

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.