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

Systemtic Name: 3-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-(4-methoxyphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-(3-chloro-4-fluoro-anilino)-1-(4-methoxyphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(3-chloro-4-fluoroanilino)-1-(4-methoxyphenyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-(3-chloro-4-fluoroanilino)-1-(4-methoxyphenyl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-(3-chloro-4-fluoro-anilino)-1-(4-methoxyphenyl)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C23H16ClFN2O3S MolecularWeight: 454.901143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C23H16ClFN2O3S/c1-30-16-10-8-15(9-11-16)27-22(28)20(26-14-7-12-19(25)18(24)13-14)21(23(27)29)31-17-5-3-2-4-6-17/h2-13,26H,1H3