Vitas-M small molecule compound
2-amino-3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carbonitrile
Catalog ID
STK690738
SMILES N#Cc1c(N)c(n2c1CCCCC2)C(=O)c1ccc2c(c1)OCCO2
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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 C19H19N3O3 MW 337.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O3/c20-11-13-14-4-2-1-3-7-22(14)18(17(13)21)19(23)12-5-6-15-16(10-12)25-9-8-24-15/h5-6,10H,1-4,7-9,21H2InChIKey
NXOYOVLBMIRYQG-UHFFFAOYSA-NSynonyms
2amino3(23dihydro14benzodioxin6ylcarbonyl)6789tetrahydro5Hpyrrolo(12a)azepine1carbonitrile
2amino3(23dihydro14benzodioxine6carbonyl)6789tetrahydro5Hpyrrolo(12a)azepine1carbonitrile
C1CCC2=C(C(=C(N2CC1)C(=O)C3=CC4=C(C=C3)OCCO4)N)C#N
InChI=1SC19H19N3O3c201113144213722(14)18(17(13)21)19(23)12561516(1012)25982415h5610H147921H2
MFCD09064037
ZINC000012375071
ZINC12375071
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