Vitas-M small molecule compound

11-benzyl-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
STL538761
SMILES COc1ccc2c(c1)CCC1C2CCC2(C1Cc1c2c2c(s1)ncn(c2=O)Cc1ccccc1)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 C30H30N2O2S MW 482.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O2S/c1-30-13-12-22-21-11-9-20(34-2)14-19(21)8-10-23(22)24(30)15-25-27(30)26-28(35-25)31-17-32(29(26)33)16-18-6-4-3-5-7-18/h3-7,9,11,14,17,22-24H,8,10,12-13,15-16H2,1-2H3
InChIKey
WIFRLFNPVPKUEU-UHFFFAOYSA-N
Synonyms
1574410-41-5
10benzyl4methoxy8amethyl6b788a101414a14boctahydro1Hnaphtho(2145)indeno(1245)thieno(23d)pyrimidin9(2H)one
11benzyl3methoxy12cmethyl566a6b71112c131414adecahydro12Hnaphtho(2145)indeno(1245)thieno(23d)pyrimidin12one
1574410415
18benzyl7methoxy14methyl22thia1820diazahexacyclo(121000^(211)0^(510)0^(1523)0^(1621))tetracosa5(10)6815(23)16(21)19hexaen17one
71826450
InChI=1SC30H30N2O2Sc1301312222111920(342)1419(21)81023(22)24(30)152527(30)2628(3525)311732(29(26)33)16186435718h3791114172224H81012131516H212H3
MFCD28051353
ZINC000108237997
ZINC000247976937

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Available files

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