N-[2-(cyanomethylsulfanyl)phenyl]-2-(2-oxidanylidene-4-propyl-chromen-7-yl)oxy-ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(2-oxidanylidene-4-propyl-chromen-7-yl)oxy-ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(2-oxo-4-propyl-chromen-7-yl)oxy-acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-[(2-oxo-4-propyl-1-benzopyran-7-yl)oxy]acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-(2-keto-4-propyl-chromen-7-yl)oxy-acetamide Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC3=CC=CC=C3SCC#N

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC3=CC=CC=C3SCC#N

InChI

InChI=1S/C22H20N2O4S/c1-2-5-15-12-22(26)28-19-13-16(8-9-17(15)19)27-14-21(25)24-18-6-3-4-7-20(18)29-11-10-23/h3-4,6-9,12-13H,2,5,11,14H2,1H3,(H,24,25)