Vitas-M small molecule compound
2-[(3-methylbutyl)sulfanyl]-3-(4-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK984218
SMILES CC(CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3)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 C22H26N2OS2 MW 398.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2OS2/c1-14(2)12-13-26-22-23-20-19(17-6-4-5-7-18(17)27-20)21(25)24(22)16-10-8-15(3)9-11-16/h8-11,14H,4-7,12-13H2,1-3H3InChIKey
HBRPKBIWJIBYHA-UHFFFAOYSA-NSynonyms
2((3methylbutyl)sulfanyl)3(4methylphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(3methylbutylsulfanyl)3(4methylphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCC(C)C)SC4=C3CCCC4
InChI=1SC22H26N2OS2c114(2)12132622232019(17645718(17)2720)21(25)24(22)1610815(3)91116h81114H471213H213H3
MFCD01907306
ZINC000002183410
ZINC02183410
ZINC2183410
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