3-(4-chlorophenyl)sulfanyl-1-(2-fluorophenyl)-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-(2-fluorophenyl)-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-(2-fluorophenyl)-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-1-(2-fluorophenyl)-4-(4-phenyl-1-piperazinyl)pyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-(2-fluorophenyl)-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-1-(2-fluorophenyl)-4-(4-phenylpiperazino)-3-pyrroline-2,5-quinone Formula: C26H21ClFN3O2S MolecularWeight: 493.980243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)N(C3=O)C4=CC=CC=C4F)SC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)N(C3=O)C4=CC=CC=C4F)SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H21ClFN3O2S/c27-18-10-12-20(13-11-18)34-24-23(25(32)31(26(24)33)22-9-5-4-8-21(22)28)30-16-14-29(15-17-30)19-6-2-1-3-7-19/h1-13H,14-17H2