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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C24H18ClFN2O2S/c1-2-15-8-11-17(12-9-15)28-23(29)21(27-16-10-13-20(26)19(25)14-16)22(24(28)30)31-18-6-4-3-5-7-18/h3-14,27H,2H2,1H3