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

Systemtic Name: 1-(4-chloranyl-2-methyl-phenyl)-3-(4-chlorophenyl)sulfanyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Openeye Name: 1-(4-chloro-2-methyl-phenyl)-3-(4-chlorophenyl)sulfanyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione CAS Name: 1-(4-chloro-2-methylphenyl)-3-[(4-chlorophenyl)thio]-4-(4-phenyl-1-piperazinyl)pyrrole-2,5-dione IUPAC Name: 1-(4-chloro-2-methylphenyl)-3-(4-chlorophenyl)sulfanyl-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Traditional Name: 1-(4-chloro-2-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=CC(=C1)Cl)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)Cl)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

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

InChI

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