Vitas-M small molecule compound
[4-(azepan-1-ylsulfonyl)phenyl](5-methylidene-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-6(5H)-yl)methanone
Catalog ID
STK584486
SMILES O=C(N1CCc2c(C1=C)cc1c(c2)OCO1)c1ccc(cc1)S(=O)(=O)N1CCCCCC1
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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 C24H26N2O5S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O5S/c1-17-21-15-23-22(30-16-31-23)14-19(21)10-13-26(17)24(27)18-6-8-20(9-7-18)32(28,29)25-11-4-2-3-5-12-25/h6-9,14-15H,1-5,10-13,16H2InChIKey
WFVINCFZGDUBSG-UHFFFAOYSA-NSynonyms
883958-87-0(4(azepan1ylsulfonyl)phenyl)(5methylene78dihydro(13)dioxolo(45g)isoquinolin6(5H)yl)methanone
(4(azepan1ylsulfonyl)phenyl)(5methylidene78dihydro(13)dioxolo(45g)isoquinolin6(5H)yl)methanone
(4(AZEPAN1YLSULFONYL)PHENYL)(5METHYLIDENE78DIHYDRO(13)DIOXOLO(45G)ISOQUINOLIN6YL)METHANONE
883958870
C=C1C2=CC3=C(C=C2CCN1C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCCC5)OCO3
InChI=1SC24H26N2O5Sc11721152322(30163123)1419(21)101326(17)24(27)186820(9718)32(2829)251142351225h691415H15101316H2
MFCD06785503
ZINC000013572509
ZINC13572509
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