2-[(4-methoxyphenyl)methyl]-4-[(4-methylsulfanylphenyl)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-4-[(4-methylsulfanylphenyl)methylidene]isoquinoline-1,3-dione Openeye Name: 2-[(4-methoxyphenyl)methyl]-4-[(4-methylsulfanylphenyl)methylene]isoquinoline-1,3-dione CAS Name: 2-[(4-methoxyphenyl)methyl]-4-[[4-(methylthio)phenyl]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-[(4-methoxyphenyl)methyl]-4-[(4-methylsulfanylphenyl)methylidene]isoquinoline-1,3-dione Traditional Name: 4-[4-(methylthio)benzylidene]-2-p-anisyl-isoquinoline-1,3-quinone Formula: C25H21NO3S MolecularWeight: 415.50414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=CC4=CC=C(C=C4)SC)C2=O

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=CC4=CC=C(C=C4)SC)C2=O

InChI

InChI=1S/C25H21NO3S/c1-29-19-11-7-18(8-12-19)16-26-24(27)22-6-4-3-5-21(22)23(25(26)28)15-17-9-13-20(30-2)14-10-17/h3-15H,16H2,1-2H3