2-(4-fluorophenyl)-6,7-dimethoxy-N-(5-piperazin-1-ylpentyl)quinazolin-4-amine

Systemtic Name: 2-(4-fluorophenyl)-6,7-dimethoxy-N-(5-piperazin-1-ylpentyl)quinazolin-4-amine Openeye Name: 2-(4-fluorophenyl)-6,7-dimethoxy-N-(5-piperazin-1-ylpentyl)quinazolin-4-amine CAS Name: 2-(4-fluorophenyl)-6,7-dimethoxy-N-[5-(1-piperazinyl)pentyl]-4-quinazolinamine IUPAC Name: 2-(4-fluorophenyl)-6,7-dimethoxy-N-(5-piperazin-1-ylpentyl)quinazolin-4-amine Traditional Name: [2-(4-fluorophenyl)-6,7-dimethoxy-quinazolin-4-yl]-(5-piperazinopentyl)amine Formula: C25H32FN5O2 MolecularWeight: 453.552283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)F)NCCCCCN4CCNCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)F)NCCCCCN4CCNCC4)OC

InChI

InChI=1S/C25H32FN5O2/c1-32-22-16-20-21(17-23(22)33-2)29-24(18-6-8-19(26)9-7-18)30-25(20)28-10-4-3-5-13-31-14-11-27-12-15-31/h6-9,16-17,27H,3-5,10-15H2,1-2H3,(H,28,29,30)