Vitas-M small molecule compound
11-[2-(4-fluorophenyl)ethyl]-3-methoxy-12c-methyl-5,6,6a,6b,7,11,12c,13,14,14a-decahydro-12H-naphtho[2'',1'':4',5']indeno[1',2':4,5]thieno[2,3-d]pyrimidin-12-one
Catalog ID
STL540492
SMILES COc1ccc2c(c1)CCC1C2CCC2(C1Cc1c2c2c(s1)ncn(c2=O)CCc1ccc(cc1)F)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 C31H31FN2O2S MW 514.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31FN2O2S/c1-31-13-11-23-22-10-8-21(36-2)15-19(22)5-9-24(23)25(31)16-26-28(31)27-29(37-26)33-17-34(30(27)35)14-12-18-3-6-20(32)7-4-18/h3-4,6-8,10,15,17,23-25H,5,9,11-14,16H2,1-2H3InChIKey
QBJIJLNMRBCIMF-UHFFFAOYSA-NSynonyms
1574472-10-810(4fluorophenethyl)4methoxy8amethyl6b788a101414a14boctahydro1Hnaphtho(2145)indeno(1245)thieno(23d)pyrimidin9(2H)one
11(2(4fluorophenyl)ethyl)3methoxy12cmethyl566a6b71112c131414adecahydro12Hnaphtho(2145)indeno(1245)thieno(23d)pyrimidin12one
1574472108
18(2(4fluorophenyl)ethyl)7methoxy14methyl22thia1820diazahexacyclo(121000^(211)0^(510)0^(1523)0^(1621))tetracosa5(10)6815(23)16(21)19hexaen17one
71827058
InChI=1SC31H31FN2O2Sc1311311232210821(362)1519(22)5924(23)25(31)162628(31)2729(3726)331734(30(27)35)1412183620(32)7418h34681015172325H59111416H212H3
MFCD28050858
ZINC000108236721
ZINC000247959607
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