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

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-phenethyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-phenethyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-1-phenethyl-4-(4-phenyl-1-piperazinyl)pyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-phenethyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-1-phenethyl-4-(4-phenylpiperazino)-3-pyrroline-2,5-quinone Formula: C28H26ClN3O2S MolecularWeight: 504.04294

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)N(C3=O)CCC4=CC=CC=C4)SC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)N(C3=O)CCC4=CC=CC=C4)SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H26ClN3O2S/c29-22-11-13-24(14-12-22)35-26-25(31-19-17-30(18-20-31)23-9-5-2-6-10-23)27(33)32(28(26)34)16-15-21-7-3-1-4-8-21/h1-14H,15-20H2