2-[(4-butanoylpiperazin-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-butanoylpiperazin-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-butanoylpiperazin-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-(1-oxobutyl)-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-butanoylpiperazin-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-butyrylpiperazino)methyl]-1H-quinazolin-4-one Formula: C17H22N4O2 MolecularWeight: 314.38218

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCC(=O)N1CCN(CC1)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H22N4O2/c1-2-5-16(22)21-10-8-20(9-11-21)12-15-18-14-7-4-3-6-13(14)17(23)19-15/h3-4,6-7H,2,5,8-12H2,1H3,(H,18,19,23)