Vitas-M small molecule compound
2-{[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]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
Catalog ID
STL304472
SMILES CSc1nc(SCC(=O)N2CCCC2)c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)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 C25H32N4O2S3 MW 516.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O2S3/c1-14(2)10-17-16-12-31-25(3,4)11-15(16)19-20-21(34-22(19)26-17)23(28-24(27-20)32-5)33-13-18(30)29-8-6-7-9-29/h14H,6-13H2,1-5H3InChIKey
SGBYCYXVPYKNMS-UHFFFAOYSA-NSynonyms
861652-04-22((22dimethyl5(2methylpropyl)10(methylsulfanyl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)1(pyrrolidin1yl)ethanone
2((5isobutyl22dimethyl10(methylthio)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)1(pyrrolidin1yl)ethanone
861652042
CC(C)CC1=C2COC(CC2=C3C4=C(C(=NC(=N4)SC)SCC(=O)N5CCCC5)SC3=N1)(C)C
InChI=1SC25H32N4O2S3c114(2)101716123125(34)1115(16)192021(3422(19)2617)23(2824(2720)325)331318(30)29867929h14H613H215H3
MFCD05686539
ZINC000009497439
ZINC09497439
ZINC9497439
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