5-butyl-7-(4-chlorophenyl)-6-methyl-1H-pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 5-butyl-7-(4-chlorophenyl)-6-methyl-1H-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-butyl-7-(4-chlorophenyl)-6-methyl-1H-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-butyl-7-(4-chlorophenyl)-6-methyl-1H-pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-butyl-7-(4-chlorophenyl)-6-methyl-1H-pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-butyl-7-(4-chlorophenyl)-6-methyl-1H-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=C(N1C)C3=CC=C(C=C3)Cl)NC(=O)NC2=O

Isomeric SMILES

CCCCC1=C2C(=C(N1C)C3=CC=C(C=C3)Cl)NC(=O)NC2=O

InChI

InChI=1S/C17H18ClN3O2/c1-3-4-5-12-13-14(19-17(23)20-16(13)22)15(21(12)2)10-6-8-11(18)9-7-10/h6-9H,3-5H2,1-2H3,(H2,19,20,22,23)