Vitas-M small molecule compound
9-[4-(methylsulfanyl)phenyl]-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK764829
SMILES CSc1ccc(cc1)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2
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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 C20H20O3S MW 340.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20O3S/c1-24-13-10-8-12(9-11-13)18-19-14(21)4-2-6-16(19)23-17-7-3-5-15(22)20(17)18/h8-11,18H,2-7H2,1H3InChIKey
RQCBDWAZYPALQW-UHFFFAOYSA-NSynonyms
9(4(methylsulfanyl)phenyl)345679hexahydro1Hxanthene18(2H)dione
9(4methylsulfanylphenyl)345679hexahydro2Hxanthene18dione
CSC1=CC=C(C=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4
InChI=1SC20H20O3Sc1241310812(91113)181914(21)42616(19)231773515(22)20(17)18h81118H27H21H3
MFCD02944460
ZINC000000035142
ZINC00035142
ZINC35142
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