3,6-diethoxy-4,5-bis(phenylsulfanyl)benzene-1,2-dicarbonitrile

Systemtic Name: 3,6-diethoxy-4,5-bis(phenylsulfanyl)benzene-1,2-dicarbonitrile Openeye Name: 3,6-diethoxy-4,5-bis(phenylsulfanyl)phthalonitrile CAS Name: 3,6-diethoxy-4,5-bis(phenylthio)benzene-1,2-dicarbonitrile IUPAC Name: 3,6-diethoxy-4,5-bis(phenylsulfanyl)benzene-1,2-dicarbonitrile Traditional Name: 3,6-diethoxy-4,5-bis(phenylthio)phthalonitrile Formula: C24H20N2O2S2 MolecularWeight: 432.5578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=C1C#N)C#N)OCC)SC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=C(C(=C1C#N)C#N)OCC)SC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C24H20N2O2S2/c1-3-27-21-19(15-25)20(16-26)22(28-4-2)24(30-18-13-9-6-10-14-18)23(21)29-17-11-7-5-8-12-17/h5-14H,3-4H2,1-2H3