Vitas-M small molecule compound
(2Z)-N-(1,3-benzodioxol-5-ylmethyl)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)ethanamide
Catalog ID
STK571018
SMILES O=C(/C=C/1\NCCc2c1cc1OCOc1c2)NCc1ccc2c(c1)OCO2
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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 C20H18N2O5 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5/c23-20(22-9-12-1-2-16-17(5-12)25-10-24-16)8-15-14-7-19-18(26-11-27-19)6-13(14)3-4-21-15/h1-2,5-8,21H,3-4,9-11H2,(H,22,23)/b15-8-InChIKey
SBQPZGCEENAWJR-NVNXTCNLSA-NSynonyms
(2Z)N(13benzodioxol5ylmethyl)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)ethanamide
(2Z)N(13benzodioxol5ylmethyl)2(78dihydro6H(13)dioxolo(45g)isoquinolin5ylidene)acetamide
(Z)N(benzo(d)(13)dioxol5ylmethyl)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)acetamide
C1CNC(=CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC5=C(C=C41)OCO5
InChI=1SC20H18N2O5c2320(22912121617(512)25102416)8151471918(26112719)613(14)342115h125821H34911H2(H2223)b158
MFCD07640687
O=C(C=C1NCCc2c1cc1OCOc1c2)NCc1ccc2c(c1)OCO2
ZINC000005451267
ZINC05451267
ZINC5451267
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