1-[[2,6-bis(fluoranyl)phenyl]methyl]-7-ethyl-5-piperazin-1-yl-3,4-dihydroquinazolin-2-one

Systemtic Name: 1-[[2,6-bis(fluoranyl)phenyl]methyl]-7-ethyl-5-piperazin-1-yl-3,4-dihydroquinazolin-2-one Openeye Name: 1-[(2,6-difluorophenyl)methyl]-7-ethyl-5-piperazin-1-yl-3,4-dihydroquinazolin-2-one CAS Name: 1-[(2,6-difluorophenyl)methyl]-7-ethyl-5-(1-piperazinyl)-3,4-dihydroquinazolin-2-one IUPAC Name: 1-[(2,6-difluorophenyl)methyl]-7-ethyl-5-piperazin-1-yl-3,4-dihydroquinazolin-2-one Traditional Name: 1-(2,6-difluorobenzyl)-7-ethyl-5-piperazino-3,4-dihydroquinazolin-2-one Formula: C21H24F2N4O MolecularWeight: 386.438266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(CNC(=O)N2CC3=C(C=CC=C3F)F)C(=C1)N4CCNCC4

Isomeric SMILES

CCC1=CC2=C(CNC(=O)N2CC3=C(C=CC=C3F)F)C(=C1)N4CCNCC4

InChI

InChI=1S/C21H24F2N4O/c1-2-14-10-19(26-8-6-24-7-9-26)15-12-25-21(28)27(20(15)11-14)13-16-17(22)4-3-5-18(16)23/h3-5,10-11,24H,2,6-9,12-13H2,1H3,(H,25,28)