N-[4-bromanyl-2,6-bis(fluoranyl)phenyl]-6-methoxy-7-(piperidin-4-ylmethoxy)quinazolin-4-amine

Systemtic Name: N-[4-bromanyl-2,6-bis(fluoranyl)phenyl]-6-methoxy-7-(piperidin-4-ylmethoxy)quinazolin-4-amine Openeye Name: N-(4-bromo-2,6-difluoro-phenyl)-6-methoxy-7-(4-piperidylmethoxy)quinazolin-4-amine CAS Name: N-(4-bromo-2,6-difluorophenyl)-6-methoxy-7-(4-piperidinylmethoxy)-4-quinazolinamine IUPAC Name: N-(4-bromo-2,6-difluorophenyl)-6-methoxy-7-(piperidin-4-ylmethoxy)quinazolin-4-amine Traditional Name: (4-bromo-2,6-difluoro-phenyl)-[6-methoxy-7-(4-piperidylmethoxy)quinazolin-4-yl]amine Formula: C21H21BrF2N4O2 MolecularWeight: 479.317846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3F)Br)F)OCC4CCNCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3F)Br)F)OCC4CCNCC4

InChI

InChI=1S/C21H21BrF2N4O2/c1-29-18-8-14-17(9-19(18)30-10-12-2-4-25-5-3-12)26-11-27-21(14)28-20-15(23)6-13(22)7-16(20)24/h6-9,11-12,25H,2-5,10H2,1H3,(H,26,27,28)