Vitas-M small molecule compound
2-{4-[2,2-dimethyl-5-(2-methylpropyl)-10-(methylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]piperazin-1-yl}ethanol
Catalog ID
STL227101
SMILES OCCN1CCN(CC1)c1nc(SC)nc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC(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 C25H35N5O2S2 MW 501.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H35N5O2S2/c1-15(2)12-18-17-14-32-25(3,4)13-16(17)19-20-21(34-23(19)26-18)22(28-24(27-20)33-5)30-8-6-29(7-9-30)10-11-31/h15,31H,6-14H2,1-5H3InChIKey
PWXRPEKWNWJKCX-UHFFFAOYSA-NSynonyms
861109-81-12(4(22dimethyl5(2methylpropyl)10(methylsulfanyl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)piperazin1yl)ethanol
2(4(5isobutyl22dimethyl10(methylthio)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)piperazin1yl)ethanol
861109811
CC(C)CC1=C2COC(CC2=C3C4=C(C(=NC(=N4)SC)N5CCN(CC5)CCO)SC3=N1)(C)C
InChI=1SC25H35N5O2S2c115(2)121817143225(34)1316(17)192021(3423(19)2618)22(2824(2720)335)308629(7930)101131h1531H614H215H3
MFCD05682358
ZINC000020463326
ZINC20463326
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