1-(4-chloranyl-2-methyl-phenyl)-3-morpholin-4-yl-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 1-(4-chloranyl-2-methyl-phenyl)-3-morpholin-4-yl-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(4-chloro-2-methyl-phenyl)-3-morpholino-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(4-chloro-2-methylphenyl)-3-(4-morpholinyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(4-chloro-2-methylphenyl)-3-morpholin-4-yl-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(4-chloro-2-methyl-phenyl)-3-morpholino-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN2O3S/c1-14-13-15(22)7-8-17(14)24-20(25)18(23-9-11-27-12-10-23)19(21(24)26)28-16-5-3-2-4-6-16/h2-8,13H,9-12H2,1H3