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

Systemtic Name: 4-methylsulfanyl-6-[4-[2-[methylsulfanyl-(phenylmethyl)amino]ethoxy]phenyl]-2-oxidanylidene-pyran-3-carbonitrile Openeye Name: 6-[4-[2-[benzyl(methylsulfanyl)amino]ethoxy]phenyl]-4-methylsulfanyl-2-oxo-pyran-3-carbonitrile CAS Name: N-[2-[4-[5-cyano-4-(methylthio)-6-oxo-2-pyranyl]phenoxy]ethyl]-N-(phenylmethyl)methanesulfenamide IUPAC Name: 6-[4-[2-[benzyl(methylsulfanyl)amino]ethoxy]phenyl]-4-methylsulfanyl-2-oxopyran-3-carbonitrile Traditional Name: 6-[4-[2-[benzyl-(methylthio)amino]ethoxy]phenyl]-2-keto-4-(methylthio)pyran-3-carbonitrile Formula: C23H22N2O3S2 MolecularWeight: 438.56238

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)OC(=C1)C2=CC=C(C=C2)OCCN(CC3=CC=CC=C3)SC)C#N

Isomeric SMILES

CSC1=C(C(=O)OC(=C1)C2=CC=C(C=C2)OCCN(CC3=CC=CC=C3)SC)C#N

InChI

InChI=1S/C23H22N2O3S2/c1-29-22-14-21(28-23(26)20(22)15-24)18-8-10-19(11-9-18)27-13-12-25(30-2)16-17-6-4-3-5-7-17/h3-11,14H,12-13,16H2,1-2H3