1-[(3-chloranyl-2-fluoranyl-phenyl)methyl]-5-piperazin-1-yl-3,4-dihydroquinazolin-2-one hydrochloride

Systemtic Name: 1-[(3-chloranyl-2-fluoranyl-phenyl)methyl]-5-piperazin-1-yl-3,4-dihydroquinazolin-2-one hydrochloride Openeye Name: 1-[(3-chloro-2-fluoro-phenyl)methyl]-5-piperazin-1-yl-3,4-dihydroquinazolin-2-one hydrochloride CAS Name: 1-[(3-chloro-2-fluorophenyl)methyl]-5-(1-piperazinyl)-3,4-dihydroquinazolin-2-one hydrochloride IUPAC Name: 1-[(3-chloro-2-fluorophenyl)methyl]-5-piperazin-1-yl-3,4-dihydroquinazolin-2-one hydrochloride Traditional Name: 1-(3-chloro-2-fluoro-benzyl)-5-piperazino-3,4-dihydroquinazolin-2-one hydrochloride Formula: C19H21Cl2FN4O MolecularWeight: 411.300643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2CNC(=O)N3CC4=C(C(=CC=C4)Cl)F.Cl

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2CNC(=O)N3CC4=C(C(=CC=C4)Cl)F.Cl

InChI

InChI=1S/C19H20ClFN4O.ClH/c20-15-4-1-3-13(18(15)21)12-25-17-6-2-5-16(14(17)11-23-19(25)26)24-9-7-22-8-10-24;/h1-6,22H,7-12H2,(H,23,26);1H