Vitas-M small molecule compound
2-{[5-(furan-2-yl)-2,2-dimethyl-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-(piperidin-1-yl)ethanone
Catalog ID
STL304480
SMILES CSc1nc(SCC(=O)N2CCCCC2)c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)c1ccco1
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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 C26H28N4O3S3 MW 540.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3S3/c1-26(2)12-15-16(13-33-26)20(17-8-7-11-32-17)27-23-19(15)21-22(36-23)24(29-25(28-21)34-3)35-14-18(31)30-9-5-4-6-10-30/h7-8,11H,4-6,9-10,12-14H2,1-3H3InChIKey
WWGRIVZTTBOILD-UHFFFAOYSA-NSynonyms
845650-20-62((5(furan2yl)22dimethyl10(methylsulfanyl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)1(piperidin1yl)ethanone
2((5(furan2yl)22dimethyl10(methylthio)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)1(piperidin1yl)ethanone
845650206
CC1(CC2=C3C4=C(C(=NC(=N4)SC)SCC(=O)N5CCCCC5)SC3=NC(=C2CO1)C6=CC=CO6)C
InChI=1SC26H28N4O3S3c126(2)121516(133326)20(1787113217)272319(15)2122(3623)24(2925(2821)343)351418(31)3095461030h7811H469101214H213H3
MFCD04167673
ZINC000002414885
ZINC2414885
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