6-[2-(aminomethyl)-1,3-thiazol-4-yl]-N-(3-fluoranyl-4-phenylmethoxy-phenyl)quinazolin-4-amine

Systemtic Name: 6-[2-(aminomethyl)-1,3-thiazol-4-yl]-N-(3-fluoranyl-4-phenylmethoxy-phenyl)quinazolin-4-amine Openeye Name: 6-[2-(aminomethyl)thiazol-4-yl]-N-(4-benzyloxy-3-fluoro-phenyl)quinazolin-4-amine CAS Name: 6-[2-(aminomethyl)-4-thiazolyl]-N-(3-fluoro-4-phenylmethoxyphenyl)-4-quinazolinamine IUPAC Name: 6-[2-(aminomethyl)-1,3-thiazol-4-yl]-N-(3-fluoro-4-phenylmethoxyphenyl)quinazolin-4-amine Traditional Name: [6-[2-(aminomethyl)thiazol-4-yl]quinazolin-4-yl]-(4-benzoxy-3-fluoro-phenyl)amine Formula: C25H20FN5OS MolecularWeight: 457.522603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C5=CSC(=N5)CN)F

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C5=CSC(=N5)CN)F

InChI

InChI=1S/C25H20FN5OS/c26-20-11-18(7-9-23(20)32-13-16-4-2-1-3-5-16)30-25-19-10-17(6-8-21(19)28-15-29-25)22-14-33-24(12-27)31-22/h1-11,14-15H,12-13,27H2,(H,28,29,30)