1-[2,3-bis(chloranyl)phenyl]-3-(4-phenylpiperazin-1-yl)-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 1-[2,3-bis(chloranyl)phenyl]-3-(4-phenylpiperazin-1-yl)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(2,3-dichlorophenyl)-3-(4-phenylpiperazin-1-yl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(2,3-dichlorophenyl)-3-(4-phenyl-1-piperazinyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(2,3-dichlorophenyl)-3-(4-phenylpiperazin-1-yl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(2,3-dichlorophenyl)-3-(4-phenylpiperazino)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C26H21Cl2N3O2S MolecularWeight: 510.43484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H21Cl2N3O2S/c27-20-12-7-13-21(22(20)28)31-25(32)23(24(26(31)33)34-19-10-5-2-6-11-19)30-16-14-29(15-17-30)18-8-3-1-4-9-18/h1-13H,14-17H2