Vitas-M small molecule compound
3-(4-methoxyphenyl)-2-[(3-methylbutyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK805074
SMILES COc1ccc(cc1)n1c(SCCC(C)C)nc2c(c1=O)c1CCCCc1s2
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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 C22H26N2O2S2 MW 414.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O2S2/c1-14(2)12-13-27-22-23-20-19(17-6-4-5-7-18(17)28-20)21(25)24(22)15-8-10-16(26-3)11-9-15/h8-11,14H,4-7,12-13H2,1-3H3InChIKey
KVRNIXPEIGZJAK-UHFFFAOYSA-NSynonyms
354992-51-12(isopentylthio)3(4methoxyphenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(4methoxyphenyl)2((3methylbutyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4methoxyphenyl)2(3methylbutylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
354992511
CC(C)CCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)OC
InChI=1SC22H26N2O2S2c114(2)12132722232019(17645718(17)2820)21(25)24(22)1581016(263)11915h81114H471213H213H3
MFCD01876779
ZINC000002183414
ZINC02183414
ZINC2183414
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