Vitas-M small molecule compound

3,4-dihydroisoquinolin-2(1H)-yl[4-(methylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methanone

Catalog ID
STL353560
SMILES O=C(C1Oc2ccccc2N(C1)S(=O)(=O)C)N1CCc2c(C1)cccc2

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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 C19H20N2O4S MW 372.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O4S/c1-26(23,24)21-13-18(25-17-9-5-4-8-16(17)21)19(22)20-11-10-14-6-2-3-7-15(14)12-20/h2-9,18H,10-13H2,1H3
InChIKey
VXUNFUVUAOPDOH-UHFFFAOYSA-N
Synonyms

34dihydro1Hisoquinolin2yl(4methylsulfonyl23dihydro14benzoxazin2yl)methanone
34dihydroisoquinolin2(1H)yl(4(methylsulfonyl)34dihydro2H14benzoxazin2yl)methanone
CS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)N3CCC4=CC=CC=C4C3
InChI=1SC19H20N2O4Sc126(2324)211318(2517954816(17)21)19(22)20111014623715(14)1220h2918H1013H21H3
MFCD13032485
ZINC000020108531
ZINC000020108533

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Available files

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