2-[(3-fluorophenyl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine Openeye Name: 2-[(3-fluorophenyl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine CAS Name: 2-[(3-fluorophenyl)methylthio]-N-[(4-methoxyphenyl)methyl]-4-quinazolinamine IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine Traditional Name: [2-[(3-fluorobenzyl)thio]quinazolin-4-yl]-p-anisyl-amine Formula: C23H20FN3OS MolecularWeight: 405.487803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)SCC4=CC(=CC=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)SCC4=CC(=CC=C4)F

InChI

InChI=1S/C23H20FN3OS/c1-28-19-11-9-16(10-12-19)14-25-22-20-7-2-3-8-21(20)26-23(27-22)29-15-17-5-4-6-18(24)13-17/h2-13H,14-15H2,1H3,(H,25,26,27)