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

Systemtic Name: N-(3-chloranyl-2-fluoranyl-phenyl)-7-methoxy-6-(piperidin-4-ylmethoxy)quinazolin-4-amine Openeye Name: N-(3-chloro-2-fluoro-phenyl)-7-methoxy-6-(4-piperidylmethoxy)quinazolin-4-amine CAS Name: N-(3-chloro-2-fluorophenyl)-7-methoxy-6-(4-piperidinylmethoxy)-4-quinazolinamine IUPAC Name: N-(3-chloro-2-fluorophenyl)-7-methoxy-6-(piperidin-4-ylmethoxy)quinazolin-4-amine Traditional Name: (3-chloro-2-fluoro-phenyl)-[7-methoxy-6-(4-piperidylmethoxy)quinazolin-4-yl]amine Formula: C21H22ClFN4O2 MolecularWeight: 416.876383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=C(C(=CC=C3)Cl)F)OCC4CCNCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=C(C(=CC=C3)Cl)F)OCC4CCNCC4

InChI

InChI=1S/C21H22ClFN4O2/c1-28-18-10-17-14(9-19(18)29-11-13-5-7-24-8-6-13)21(26-12-25-17)27-16-4-2-3-15(22)20(16)23/h2-4,9-10,12-13,24H,5-8,11H2,1H3,(H,25,26,27)