1-(3-chloranyl-4-methyl-phenyl)-3-(4-chlorophenyl)sulfanyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-(4-chlorophenyl)sulfanyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-(4-chlorophenyl)sulfanyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione CAS Name: 1-(3-chloro-4-methylphenyl)-3-[(4-chlorophenyl)thio]-4-(4-phenyl-1-piperazinyl)pyrrole-2,5-dione IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-(4-chlorophenyl)sulfanyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[(4-chlorophenyl)thio]-4-(4-phenylpiperazino)-3-pyrroline-2,5-quinone Formula: C27H23Cl2N3O2S MolecularWeight: 524.46142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)Cl)N4CCN(CC4)C5=CC=CC=C5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)Cl)N4CCN(CC4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C27H23Cl2N3O2S/c1-18-7-10-21(17-23(18)29)32-26(33)24(25(27(32)34)35-22-11-8-19(28)9-12-22)31-15-13-30(14-16-31)20-5-3-2-4-6-20/h2-12,17H,13-16H2,1H3