4-(2-chloranyl-6-fluoranyl-phenyl)-6-[2-(4-chlorophenyl)ethyl]-1,3,4,7-tetrahydropyrrolo[3,4-d]pyrimidine-2,5-dione

Systemtic Name: 4-(2-chloranyl-6-fluoranyl-phenyl)-6-[2-(4-chlorophenyl)ethyl]-1,3,4,7-tetrahydropyrrolo[3,4-d]pyrimidine-2,5-dione Openeye Name: 4-(2-chloro-6-fluoro-phenyl)-6-[2-(4-chlorophenyl)ethyl]-1,3,4,7-tetrahydropyrrolo[3,4-d]pyrimidine-2,5-dione CAS Name: 4-(2-chloro-6-fluorophenyl)-6-[2-(4-chlorophenyl)ethyl]-1,3,4,7-tetrahydropyrrolo[3,4-d]pyrimidine-2,5-dione IUPAC Name: 4-(2-chloro-6-fluorophenyl)-6-[2-(4-chlorophenyl)ethyl]-1,3,4,7-tetrahydropyrrolo[3,4-d]pyrimidine-2,5-dione Traditional Name: 4-(2-chloro-6-fluoro-phenyl)-6-[2-(4-chlorophenyl)ethyl]-1,3,4,7-tetrahydropyrrolo[3,4-d]pyrimidine-2,5-quinone Formula: C20H16Cl2FN3O2 MolecularWeight: 420.264343

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(NC(=O)N2)C3=C(C=CC=C3Cl)F)C(=O)N1CCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C2=C(C(NC(=O)N2)C3=C(C=CC=C3Cl)F)C(=O)N1CCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H16Cl2FN3O2/c21-12-6-4-11(5-7-12)8-9-26-10-15-17(19(26)27)18(25-20(28)24-15)16-13(22)2-1-3-14(16)23/h1-7,18H,8-10H2,(H2,24,25,28)