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

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylphenyl)-4-piperidin-1-yl-pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylphenyl)-4-(1-piperidyl)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-1-(3,5-dimethylphenyl)-4-(1-piperidinyl)pyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylphenyl)-4-piperidin-1-ylpyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-1-(3,5-dimethylphenyl)-4-piperidino-3-pyrroline-2,5-quinone Formula: C23H23ClN2O2S MolecularWeight: 426.95892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClN2O2S/c1-15-12-16(2)14-18(13-15)26-22(27)20(25-10-4-3-5-11-25)21(23(26)28)29-19-8-6-17(24)7-9-19/h6-9,12-14H,3-5,10-11H2,1-2H3