Vitas-M small molecule compound

4-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)-1-methylquinolin-2(1H)-one

Catalog ID
STK666381
SMILES Cn1c(=O)cc(c2c1cccc2)C1OC2CCCCC2c2c1ccs2

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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 C21H21NO2S MW 351.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO2S/c1-22-17-8-4-2-6-13(17)16(12-19(22)23)20-15-10-11-25-21(15)14-7-3-5-9-18(14)24-20/h2,4,6,8,10-12,14,18,20H,3,5,7,9H2,1H3
InChIKey
MZUCILPNLOGHPD-UHFFFAOYSA-N
Synonyms

4(5a67899ahexahydro4Hthieno(32c)chromen4yl)1methylquinolin2(1H)one
4(5a67899ahexahydro4Hthieno(32c)chromen4yl)1methylquinolin2one
CN1C2=CC=CC=C2C(=CC1=O)C3C4=C(C5CCCCC5O3)SC=C4
InChI=1SC21H21NO2Sc12217842613(17)16(1219(22)23)201510112521(15)14735918(14)2420h24681012141820H3579H21H3
MFCD07800807
ZINC000006667980
ZINC000245226264

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.