N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-6-methylsulfanyl-quinazolin-4-amine

Systemtic Name: N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-6-methylsulfanyl-quinazolin-4-amine Openeye Name: N-[(3-fluoro-4-methoxy-phenyl)methyl]-6-methylsulfanyl-quinazolin-4-amine CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-6-(methylthio)-4-quinazolinamine IUPAC Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-6-methylsulfanylquinazolin-4-amine Traditional Name: (3-fluoro-4-methoxy-benzyl)-[6-(methylthio)quinazolin-4-yl]amine Formula: C17H16FN3OS MolecularWeight: 329.391843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NC=NC3=C2C=C(C=C3)SC)F

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NC=NC3=C2C=C(C=C3)SC)F

InChI

InChI=1S/C17H16FN3OS/c1-22-16-6-3-11(7-14(16)18)9-19-17-13-8-12(23-2)4-5-15(13)20-10-21-17/h3-8,10H,9H2,1-2H3,(H,19,20,21)