3-[[4-(3-oxidanylidenepiperazin-1-yl)carbonylcyclohexyl]methyl]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[[4-(3-oxidanylidenepiperazin-1-yl)carbonylcyclohexyl]methyl]-1H-quinazoline-2,4-dione Openeye Name: 3-[[4-(3-oxopiperazine-1-carbonyl)cyclohexyl]methyl]-1H-quinazoline-2,4-dione CAS Name: 3-[[4-[oxo-(3-oxo-1-piperazinyl)methyl]cyclohexyl]methyl]-1H-quinazoline-2,4-dione IUPAC Name: 3-[[4-(3-oxopiperazine-1-carbonyl)cyclohexyl]methyl]-1H-quinazoline-2,4-dione Traditional Name: 3-[[4-(3-ketopiperazine-1-carbonyl)cyclohexyl]methyl]-1H-quinazoline-2,4-quinone Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C(=O)C3=CC=CC=C3NC2=O)C(=O)N4CCNC(=O)C4

Isomeric SMILES

C1CC(CCC1CN2C(=O)C3=CC=CC=C3NC2=O)C(=O)N4CCNC(=O)C4

InChI

InChI=1S/C20H24N4O4/c25-17-12-23(10-9-21-17)18(26)14-7-5-13(6-8-14)11-24-19(27)15-3-1-2-4-16(15)22-20(24)28/h1-4,13-14H,5-12H2,(H,21,25)(H,22,28)