2-cyclohexyl-4-[(2-fluorophenyl)methylsulfanyl]-6-methyl-pyrrolo[3,4-c]pyridine-1,3-dione

Systemtic Name: 2-cyclohexyl-4-[(2-fluorophenyl)methylsulfanyl]-6-methyl-pyrrolo[3,4-c]pyridine-1,3-dione Openeye Name: 2-cyclohexyl-4-[(2-fluorophenyl)methylsulfanyl]-6-methyl-pyrrolo[3,4-c]pyridine-1,3-dione CAS Name: 2-cyclohexyl-4-[(2-fluorophenyl)methylthio]-6-methylpyrrolo[3,4-c]pyridine-1,3-dione IUPAC Name: 2-cyclohexyl-4-[(2-fluorophenyl)methylsulfanyl]-6-methylpyrrolo[3,4-c]pyridine-1,3-dione Traditional Name: 2-cyclohexyl-4-[(2-fluorobenzyl)thio]-6-methyl-pyrrolo[3,4-c]pyridine-1,3-quinone Formula: C21H21FN2O2S MolecularWeight: 384.467043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=C1)C(=O)N(C2=O)C3CCCCC3)SCC4=CC=CC=C4F

Isomeric SMILES

CC1=NC(=C2C(=C1)C(=O)N(C2=O)C3CCCCC3)SCC4=CC=CC=C4F

InChI

InChI=1S/C21H21FN2O2S/c1-13-11-16-18(19(23-13)27-12-14-7-5-6-10-17(14)22)21(26)24(20(16)25)15-8-3-2-4-9-15/h5-7,10-11,15H,2-4,8-9,12H2,1H3