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

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-morpholin-4-yl-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-morpholino-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-(4-morpholinyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-morpholin-4-yl-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-morpholino-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C21H19ClN2O4S/c1-27-17-8-7-14(22)13-16(17)24-20(25)18(23-9-11-28-12-10-23)19(21(24)26)29-15-5-3-2-4-6-15/h2-8,13H,9-12H2,1H3