Vitas-M small molecule compound

3-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)-7-methoxy-2H-chromen-2-one

Catalog ID
STL133406
SMILES COc1ccc2c(c1)oc(=O)c(c2)S(=O)(=O)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 C19H17NO5S MW 371.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO5S/c1-24-16-7-6-14-10-18(19(21)25-17(14)11-16)26(22,23)20-9-8-13-4-2-3-5-15(13)12-20/h2-7,10-11H,8-9,12H2,1H3
InChIKey
BXRIPCIQWUHSFS-UHFFFAOYSA-N
Synonyms
950281-11-5
3((34DIHYDROISOQUINOLIN2(1H)YL)SULFONYL)7METHOXY2HCHROMEN2ONE
3(34dihydro1Hisoquinolin2ylsulfonyl)7methoxychromen2one
3(34dihydroisoquinolin2(1H)ylsulfonyl)7methoxy2Hchromen2one
950281115
COC1=CC2=C(C=C1)C=C(C(=O)O2)S(=O)(=O)N3CCC4=CC=CC=C4C3
InChI=1SC19H17NO5Sc1241676141018(19(21)2517(14)1116)26(2223)209813423515(13)1220h271011H8912H21H3
MFCD11994033
ZINC000015862220
ZINC15862220

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Available files

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