5-(2,4-dichlorophenyl)-1,3-dimethyl-6-phenethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 5-(2,4-dichlorophenyl)-1,3-dimethyl-6-phenethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(2,4-dichlorophenyl)-1,3-dimethyl-6-phenethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(2,4-dichlorophenyl)-1,3-dimethyl-6-phenethylpyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(2,4-dichlorophenyl)-1,3-dimethyl-6-phenethylpyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(2,4-dichlorophenyl)-1,3-dimethyl-6-phenethyl-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C22H19Cl2N3O2 MolecularWeight: 428.31116

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=C(C=C(C=C3)Cl)Cl)CCC4=CC=CC=C4

Isomeric SMILES

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=C(C=C(C=C3)Cl)Cl)CCC4=CC=CC=C4

InChI

InChI=1S/C22H19Cl2N3O2/c1-25-18-13-27(11-10-14-6-4-3-5-7-14)20(16-9-8-15(23)12-17(16)24)19(18)21(28)26(2)22(25)29/h3-9,12-13H,10-11H2,1-2H3