1-(4-bromophenyl)-3-chloranyl-4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]pyrrole-2,5-dione

Systemtic Name: 1-(4-bromophenyl)-3-chloranyl-4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]pyrrole-2,5-dione Openeye Name: 1-(4-bromophenyl)-3-chloro-4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]pyrrole-2,5-dione CAS Name: 1-(4-bromophenyl)-3-chloro-4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]pyrrole-2,5-dione IUPAC Name: 1-(4-bromophenyl)-3-chloro-4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]pyrrole-2,5-dione Traditional Name: 1-(4-bromophenyl)-3-chloro-4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-3-pyrroline-2,5-quinone Formula: C21H16BrClN4O3 MolecularWeight: 487.73374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C(C(=O)N(C3=O)C4=CC=C(C=C4)Br)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C(C(=O)N(C3=O)C4=CC=C(C=C4)Br)Cl

InChI

InChI=1S/C21H16BrClN4O3/c1-12-17(21(30)27(25(12)2)15-6-4-3-5-7-15)24-18-16(23)19(28)26(20(18)29)14-10-8-13(22)9-11-14/h3-11,24H,1-2H3