1-(3,5-dimethylphenyl)-3-phenylsulfanyl-4-piperidin-1-yl-pyrrole-2,5-dione

Systemtic Name: 1-(3,5-dimethylphenyl)-3-phenylsulfanyl-4-piperidin-1-yl-pyrrole-2,5-dione Openeye Name: 1-(3,5-dimethylphenyl)-3-phenylsulfanyl-4-(1-piperidyl)pyrrole-2,5-dione CAS Name: 1-(3,5-dimethylphenyl)-3-(phenylthio)-4-(1-piperidinyl)pyrrole-2,5-dione IUPAC Name: 1-(3,5-dimethylphenyl)-3-phenylsulfanyl-4-piperidin-1-ylpyrrole-2,5-dione Traditional Name: 1-(3,5-dimethylphenyl)-3-(phenylthio)-4-piperidino-3-pyrroline-2,5-quinone Formula: C23H24N2O2S MolecularWeight: 392.51386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)N4CCCCC4)C

InChI

InChI=1S/C23H24N2O2S/c1-16-13-17(2)15-18(14-16)25-22(26)20(24-11-7-4-8-12-24)21(23(25)27)28-19-9-5-3-6-10-19/h3,5-6,9-10,13-15H,4,7-8,11-12H2,1-2H3