7-azanyl-3-(2-chloranyl-4-fluoranyl-phenyl)-2-(piperazin-1-ylmethyl)quinazolin-4-one

Systemtic Name: 7-azanyl-3-(2-chloranyl-4-fluoranyl-phenyl)-2-(piperazin-1-ylmethyl)quinazolin-4-one Openeye Name: 7-amino-3-(2-chloro-4-fluoro-phenyl)-2-(piperazin-1-ylmethyl)quinazolin-4-one CAS Name: 7-amino-3-(2-chloro-4-fluorophenyl)-2-(1-piperazinylmethyl)-4-quinazolinone IUPAC Name: 7-amino-3-(2-chloro-4-fluorophenyl)-2-(piperazin-1-ylmethyl)quinazolin-4-one Traditional Name: 7-amino-3-(2-chloro-4-fluoro-phenyl)-2-(piperazinomethyl)quinazolin-4-one Formula: C19H19ClFN5O MolecularWeight: 387.838463

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=NC3=C(C=CC(=C3)N)C(=O)N2C4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCN1)CC2=NC3=C(C=CC(=C3)N)C(=O)N2C4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C19H19ClFN5O/c20-15-9-12(21)1-4-17(15)26-18(11-25-7-5-23-6-8-25)24-16-10-13(22)2-3-14(16)19(26)27/h1-4,9-10,23H,5-8,11,22H2