N-(2-bromanyl-5-methoxy-phenyl)-5-(piperidin-4-ylmethoxy)quinazolin-4-amine

Systemtic Name: N-(2-bromanyl-5-methoxy-phenyl)-5-(piperidin-4-ylmethoxy)quinazolin-4-amine Openeye Name: N-(2-bromo-5-methoxy-phenyl)-5-(4-piperidylmethoxy)quinazolin-4-amine CAS Name: N-(2-bromo-5-methoxyphenyl)-5-(4-piperidinylmethoxy)-4-quinazolinamine IUPAC Name: N-(2-bromo-5-methoxyphenyl)-5-(piperidin-4-ylmethoxy)quinazolin-4-amine Traditional Name: (2-bromo-5-methoxy-phenyl)-[5-(4-piperidylmethoxy)quinazolin-4-yl]amine Formula: C21H23BrN4O2 MolecularWeight: 443.33692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)NC2=NC=NC3=C2C(=CC=C3)OCC4CCNCC4

Isomeric SMILES

COC1=CC(=C(C=C1)Br)NC2=NC=NC3=C2C(=CC=C3)OCC4CCNCC4

InChI

InChI=1S/C21H23BrN4O2/c1-27-15-5-6-16(22)18(11-15)26-21-20-17(24-13-25-21)3-2-4-19(20)28-12-14-7-9-23-10-8-14/h2-6,11,13-14,23H,7-10,12H2,1H3,(H,24,25,26)