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

Systemtic Name: 3-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-(2,3-dimethylphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-(3-chloro-4-fluoro-anilino)-1-(2,3-dimethylphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(3-chloro-4-fluoroanilino)-1-(2,3-dimethylphenyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-(3-chloro-4-fluoroanilino)-1-(2,3-dimethylphenyl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-(3-chloro-4-fluoro-anilino)-1-(2,3-dimethylphenyl)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C24H18ClFN2O2S MolecularWeight: 452.928323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC(=C(C=C4)F)Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC(=C(C=C4)F)Cl)C

InChI

InChI=1S/C24H18ClFN2O2S/c1-14-7-6-10-20(15(14)2)28-23(29)21(27-16-11-12-19(26)18(25)13-16)22(24(28)30)31-17-8-4-3-5-9-17/h3-13,27H,1-2H3