1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(2,5-dimethoxyphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(2,5-dimethoxyphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2,5-dimethoxyanilino)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(3-chloro-4-fluorophenyl)-3-(2,5-dimethoxyanilino)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(2,5-dimethoxyanilino)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2,5-dimethoxyanilino)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C24H18ClFN2O4S MolecularWeight: 484.927123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC2=C(C(=O)N(C2=O)C3=CC(=C(C=C3)F)Cl)SC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC2=C(C(=O)N(C2=O)C3=CC(=C(C=C3)F)Cl)SC4=CC=CC=C4

InChI

InChI=1S/C24H18ClFN2O4S/c1-31-15-9-11-20(32-2)19(13-15)27-21-22(33-16-6-4-3-5-7-16)24(30)28(23(21)29)14-8-10-18(26)17(25)12-14/h3-13,27H,1-2H3