Vitas-M small molecule compound

2,2'-{[9-(methylsulfanyl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]imino}diethanol

Catalog ID
STL346762
SMILES OCCN(c1nc(SC)nc2c1sc1c2c2CCCc2c(n1)C(C)C)CCO

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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 C20H26N4O2S2 MW 418.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O2S2/c1-11(2)15-13-6-4-5-12(13)14-16-17(28-19(14)21-15)18(23-20(22-16)27-3)24(7-9-25)8-10-26/h11,25-26H,4-10H2,1-3H3
InChIKey
QMYKJJQCYVBHHS-UHFFFAOYSA-N
Synonyms
848992-91-6
22((4isopropyl9(methylthio)23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)azanediyl)diethanol
22((9(methylsulfanyl)4(propan2yl)23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)imino)diethanol
848992916
CC(C)C1=C2CCCC2=C3C4=C(C(=NC(=N4)SC)N(CCO)CCO)SC3=N1
InChI=1SC20H26N4O2S2c111(2)151364512(13)141617(2819(14)2115)18(2320(2216)273)24(7925)81026h112526H410H213H3
MFCD05679143
ZINC000002447063
ZINC02447063
ZINC2447063

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Available files

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