6-methyl-2-(3-methylphenyl)-4-(2-morpholin-4-ylethylsulfanyl)pyrrolo[3,4-c]pyridine-1,3-dione

Systemtic Name: 6-methyl-2-(3-methylphenyl)-4-(2-morpholin-4-ylethylsulfanyl)pyrrolo[3,4-c]pyridine-1,3-dione Openeye Name: 6-methyl-4-(2-morpholinoethylsulfanyl)-2-(m-tolyl)pyrrolo[3,4-c]pyridine-1,3-dione CAS Name: 6-methyl-2-(3-methylphenyl)-4-[2-(4-morpholinyl)ethylthio]pyrrolo[3,4-c]pyridine-1,3-dione IUPAC Name: 6-methyl-2-(3-methylphenyl)-4-(2-morpholin-4-ylethylsulfanyl)pyrrolo[3,4-c]pyridine-1,3-dione Traditional Name: 6-methyl-4-(2-morpholinoethylthio)-2-(m-tolyl)pyrrolo[3,4-c]pyridine-1,3-quinone Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC(=NC(=C3C2=O)SCCN4CCOCC4)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC(=NC(=C3C2=O)SCCN4CCOCC4)C

InChI

InChI=1S/C21H23N3O3S/c1-14-4-3-5-16(12-14)24-20(25)17-13-15(2)22-19(18(17)21(24)26)28-11-8-23-6-9-27-10-7-23/h3-5,12-13H,6-11H2,1-2H3