N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(2-methylsulfanylethoxy)quinazolin-4-amine

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(2-methylsulfanylethoxy)quinazolin-4-amine Openeye Name: N-(4-chloro-2-fluoro-phenyl)-6-methoxy-7-(2-methylsulfanylethoxy)quinazolin-4-amine CAS Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-[2-(methylthio)ethoxy]-4-quinazolinamine IUPAC Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-(2-methylsulfanylethoxy)quinazolin-4-amine Traditional Name: (4-chloro-2-fluoro-phenyl)-[6-methoxy-7-[2-(methylthio)ethoxy]quinazolin-4-yl]amine Formula: C18H17ClFN3O2S MolecularWeight: 393.862883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCCSC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCCSC

InChI

InChI=1S/C18H17ClFN3O2S/c1-24-16-8-12-15(9-17(16)25-5-6-26-2)21-10-22-18(12)23-14-4-3-11(19)7-13(14)20/h3-4,7-10H,5-6H2,1-2H3,(H,21,22,23)