Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-7-methyl-3-(2-methylprop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK829947
SMILES CC(=C)Cn1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)c1CCC(Cc1s2)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 C23H24N2O3S2 MW 440.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O3S2/c1-13(2)10-25-22(26)20-16-6-4-14(3)8-19(16)30-21(20)24-23(25)29-11-15-5-7-17-18(9-15)28-12-27-17/h5,7,9,14H,1,4,6,8,10-12H2,2-3H3InChIKey
KVVDLBFCGSPPLS-UHFFFAOYSA-NSynonyms
2((13benzodioxol5ylmethyl)sulfanyl)7methyl3(2methylprop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((benzo(d)(13)dioxol5ylmethyl)thio)7methyl3(2methylallyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2(13benzodioxol5ylmethylsulfanyl)7methyl3(2methylprop2enyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC4=CC5=C(C=C4)OCO5)CC(=C)C
InChI=1SC23H24N2O3S2c113(2)102522(26)20166414(3)819(16)3021(20)2423(25)291115571718(915)28122717h57914H14681012H223H3
MFCD02239224
ZINC000000985907
ZINC000000985908
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