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

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylphenyl)-4-morpholin-4-yl-pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylphenyl)-4-morpholino-pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-1-(3,5-dimethylphenyl)-4-(4-morpholinyl)pyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylphenyl)-4-morpholin-4-ylpyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-1-(3,5-dimethylphenyl)-4-morpholino-3-pyrroline-2,5-quinone Formula: C22H21ClN2O3S MolecularWeight: 428.93174

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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)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)Cl)N4CCOCC4)C

InChI

InChI=1S/C22H21ClN2O3S/c1-14-11-15(2)13-17(12-14)25-21(26)19(24-7-9-28-10-8-24)20(22(25)27)29-18-5-3-16(23)4-6-18/h3-6,11-13H,7-10H2,1-2H3