Vitas-M small molecule compound
4-(methoxymethyl)-6-methyl-2-{[(5,6,7-triethoxy-3-oxo-1,3-dihydro-2-benzofuran-4-yl)methyl]sulfanyl}pyridine-3-carbonitrile
Catalog ID
STL434719
SMILES COCc1cc(C)nc(c1C#N)SCc1c2C(=O)OCc2c(c(c1OCC)OCC)OCC
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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 C24H28N2O6S MW 472.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O6S/c1-6-29-20-17-12-32-24(27)19(17)18(21(30-7-2)22(20)31-8-3)13-33-23-16(10-25)15(11-28-5)9-14(4)26-23/h9H,6-8,11-13H2,1-5H3InChIKey
NGDCFCIQMSKGGI-UHFFFAOYSA-NSynonyms
4(methoxymethyl)6methyl2(((567triethoxy3oxo13dihydro2benzofuran4yl)methyl)sulfanyl)pyridine3carbonitrile
4(methoxymethyl)6methyl2((567triethoxy3oxo1H2benzofuran4yl)methylsulfanyl)pyridine3carbonitrile
CCOC1=C(C(=C(C2=C1COC2=O)CSC3=C(C(=CC(=N3)C)COC)C#N)OCC)OCC
InChI=1SC24H28N2O6Sc16292017123224(27)19(17)18(21(3072)22(20)3183)13332316(1025)15(11285)914(4)2623h9H681113H215H3
MFCD30711351
ZINC000096336494
ZINC96336494
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