Vitas-M small molecule compound
4-(3-methoxyphenyl)-5-oxo-2-(1H-pyrrol-1-yl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK783700
SMILES COc1cccc(c1)C1C(=C(OC2=C1C(=O)CCC2)n1cccc1)C#N
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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 C21H18N2O3 MW 346.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O3/c1-25-15-7-4-6-14(12-15)19-16(13-22)21(23-10-2-3-11-23)26-18-9-5-8-17(24)20(18)19/h2-4,6-7,10-12,19H,5,8-9H2,1H3InChIKey
NMEXMOMBXLCOJT-UHFFFAOYSA-NSynonyms
4(3methoxyphenyl)5oxo2(1Hpyrrol1yl)5678tetrahydro4Hchromene3carbonitrile
4(3methoxyphenyl)5oxo2pyrrol1yl4678tetrahydrochromene3carbonitrile
COC1=CC=CC(=C1)C2C(=C(OC3=C2C(=O)CCC3)N4C=CC=C4)C#N
InChI=1SC21H18N2O3c1251574614(1215)1916(1322)21(2310231123)261895817(24)20(18)19h2467101219H589H21H3
MFCD06618854
ZINC000004751889
ZINC000004751890
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