8-cyclopentyl-N-(3-fluoranyl-4-piperazin-1-yl-phenyl)-7-methoxy-quinazolin-2-amine

Systemtic Name: 8-cyclopentyl-N-(3-fluoranyl-4-piperazin-1-yl-phenyl)-7-methoxy-quinazolin-2-amine Openeye Name: 8-cyclopentyl-N-(3-fluoro-4-piperazin-1-yl-phenyl)-7-methoxy-quinazolin-2-amine CAS Name: 8-cyclopentyl-N-[3-fluoro-4-(1-piperazinyl)phenyl]-7-methoxy-2-quinazolinamine IUPAC Name: 8-cyclopentyl-N-(3-fluoro-4-piperazin-1-ylphenyl)-7-methoxyquinazolin-2-amine Traditional Name: (8-cyclopentyl-7-methoxy-quinazolin-2-yl)-(3-fluoro-4-piperazino-phenyl)amine Formula: C24H28FN5O MolecularWeight: 421.510423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=NC(=NC=C2C=C1)NC3=CC(=C(C=C3)N4CCNCC4)F)C5CCCC5

Isomeric SMILES

COC1=C(C2=NC(=NC=C2C=C1)NC3=CC(=C(C=C3)N4CCNCC4)F)C5CCCC5

InChI

InChI=1S/C24H28FN5O/c1-31-21-9-6-17-15-27-24(29-23(17)22(21)16-4-2-3-5-16)28-18-7-8-20(19(25)14-18)30-12-10-26-11-13-30/h6-9,14-16,26H,2-5,10-13H2,1H3,(H,27,28,29)