3-chloranyl-1-(2-methylphenyl)-4-[[3-(4-phenylpiperazin-1-yl)carbonylphenyl]amino]pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-1-(2-methylphenyl)-4-[[3-(4-phenylpiperazin-1-yl)carbonylphenyl]amino]pyrrole-2,5-dione Openeye Name: 3-chloro-1-(o-tolyl)-4-[3-(4-phenylpiperazine-1-carbonyl)anilino]pyrrole-2,5-dione CAS Name: 3-chloro-1-(2-methylphenyl)-4-[3-[oxo-(4-phenyl-1-piperazinyl)methyl]anilino]pyrrole-2,5-dione IUPAC Name: 3-chloro-1-(2-methylphenyl)-4-[3-(4-phenylpiperazine-1-carbonyl)anilino]pyrrole-2,5-dione Traditional Name: 3-chloro-1-(o-tolyl)-4-[3-(4-phenylpiperazine-1-carbonyl)anilino]-3-pyrroline-2,5-quinone Formula: C28H25ClN4O3 MolecularWeight: 500.9761

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H25ClN4O3/c1-19-8-5-6-13-23(19)33-27(35)24(29)25(28(33)36)30-21-10-7-9-20(18-21)26(34)32-16-14-31(15-17-32)22-11-3-2-4-12-22/h2-13,18,30H,14-17H2,1H3