4-[2-(4-methylphenyl)sulfanylethyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: 4-[2-(4-methylphenyl)sulfanylethyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: 4-[2-(p-tolylsulfanyl)ethyliminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: 4-[2-[(4-methylphenyl)thio]ethyliminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-[2-(4-methylphenyl)sulfanylethyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: 4-[2-(p-tolylthio)ethyliminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCN=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)SCCN=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C24H21N3O2S/c1-17-9-11-18(12-10-17)30-15-14-25-16-21-19-6-2-3-7-20(19)23(28)27(24(21)29)22-8-4-5-13-26-22/h2-13,16,21H,14-15H2,1H3