6-[4-[2-[methyl-(phenylmethyl)amino]ethoxy]phenyl]-4-methylsulfanyl-2-oxidanylidene-pyran-3-carbonitrile

Systemtic Name: 6-[4-[2-[methyl-(phenylmethyl)amino]ethoxy]phenyl]-4-methylsulfanyl-2-oxidanylidene-pyran-3-carbonitrile Openeye Name: 6-[4-[2-[benzyl(methyl)amino]ethoxy]phenyl]-4-methylsulfanyl-2-oxo-pyran-3-carbonitrile CAS Name: 6-[4-[2-[methyl-(phenylmethyl)amino]ethoxy]phenyl]-4-(methylthio)-2-oxo-3-pyrancarbonitrile IUPAC Name: 6-[4-[2-[benzyl(methyl)amino]ethoxy]phenyl]-4-methylsulfanyl-2-oxopyran-3-carbonitrile Traditional Name: 6-[4-[2-[benzyl(methyl)amino]ethoxy]phenyl]-2-keto-4-(methylthio)pyran-3-carbonitrile Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)C2=CC(=C(C(=O)O2)C#N)SC)CC3=CC=CC=C3

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)C2=CC(=C(C(=O)O2)C#N)SC)CC3=CC=CC=C3

InChI

InChI=1S/C23H22N2O3S/c1-25(16-17-6-4-3-5-7-17)12-13-27-19-10-8-18(9-11-19)21-14-22(29-2)20(15-24)23(26)28-21/h3-11,14H,12-13,16H2,1-2H3