N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(thiophen-3-ylmethoxy)quinazolin-4-amine hydrochloride

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(thiophen-3-ylmethoxy)quinazolin-4-amine hydrochloride Openeye Name: N-(4-chloro-2-fluoro-phenyl)-6-methoxy-7-(3-thienylmethoxy)quinazolin-4-amine hydrochloride CAS Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-(3-thiophenylmethoxy)-4-quinazolinamine hydrochloride IUPAC Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-(thiophen-3-ylmethoxy)quinazolin-4-amine hydrochloride Traditional Name: (4-chloro-2-fluoro-phenyl)-[6-methoxy-7-(3-thenyloxy)quinazolin-4-yl]amine hydrochloride Formula: C20H16Cl2FN3O2S MolecularWeight: 452.329343

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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)OCC4=CSC=C4.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCC4=CSC=C4.Cl

InChI

InChI=1S/C20H15ClFN3O2S.ClH/c1-26-18-7-14-17(8-19(18)27-9-12-4-5-28-10-12)23-11-24-20(14)25-16-3-2-13(21)6-15(16)22;/h2-8,10-11H,9H2,1H3,(H,23,24,25);1H