Vitas-M small molecule compound

2-{[2,2-dimethyl-10-(methylsulfanyl)-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}-1-phenylethanone

Catalog ID
STL448078
SMILES CSc1nc(SCC(=O)c2ccccc2)c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)N1CCOCC1

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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 C27H28N4O3S3 MW 552.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S3/c1-27(2)13-17-18(14-34-27)23(31-9-11-33-12-10-31)29-24-20(17)21-22(37-24)25(30-26(28-21)35-3)36-15-19(32)16-7-5-4-6-8-16/h4-8H,9-15H2,1-3H3
InChIKey
ZWFSGTKGEPRLAL-UHFFFAOYSA-N
Synonyms

2((22dimethyl10(methylsulfanyl)5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)1phenylethanone
CC1(CC2=C3C4=C(C(=NC(=N4)SC)SCC(=O)C5=CC=CC=C5)SC3=NC(=C2CO1)N6CCOCC6)C
InChI=1SC27H28N4O3S3c127(2)131718(143427)23(3191133121031)292420(17)2122(3724)25(3026(2821)353)361519(32)167546816h48H915H213H3
MFCD07773597
ZINC000008767918
ZINC8767918

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Available files

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