5,6-bis(4-methoxyphenyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carbonitrile

Systemtic Name: 5,6-bis(4-methoxyphenyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carbonitrile Openeye Name: 5,6-bis(4-methoxyphenyl)-4-methylsulfanyl-2-oxo-pyran-3-carbonitrile CAS Name: 5,6-bis(4-methoxyphenyl)-4-(methylthio)-2-oxo-3-pyrancarbonitrile IUPAC Name: 5,6-bis(4-methoxyphenyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile Traditional Name: 2-keto-5,6-bis(4-methoxyphenyl)-4-(methylthio)pyran-3-carbonitrile Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(OC(=O)C(=C2SC)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(OC(=O)C(=C2SC)C#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H17NO4S/c1-24-15-8-4-13(5-9-15)18-19(14-6-10-16(25-2)11-7-14)26-21(23)17(12-22)20(18)27-3/h4-11H,1-3H3