2-azanyl-N-[8-[(4-bromophenyl)methyl]-8-azabicyclo[3.2.1]octan-3-yl]-4-methoxy-pyrimidine-5-carboxamide

Systemtic Name: 2-azanyl-N-[8-[(4-bromophenyl)methyl]-8-azabicyclo[3.2.1]octan-3-yl]-4-methoxy-pyrimidine-5-carboxamide Openeye Name: 2-amino-N-[8-[(4-bromophenyl)methyl]-8-azabicyclo[3.2.1]octan-3-yl]-4-methoxy-pyrimidine-5-carboxamide CAS Name: 2-amino-N-[8-[(4-bromophenyl)methyl]-8-azabicyclo[3.2.1]octan-3-yl]-4-methoxy-5-pyrimidinecarboxamide IUPAC Name: 2-amino-N-[8-[(4-bromophenyl)methyl]-8-azabicyclo[3.2.1]octan-3-yl]-4-methoxypyrimidine-5-carboxamide Traditional Name: 2-amino-N-[8-(4-bromobenzyl)-8-azabicyclo[3.2.1]octan-3-yl]-4-methoxy-pyrimidine-5-carboxamide Formula: C20H24BrN5O2 MolecularWeight: 446.34086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C(=O)NC2CC3CCC(C2)N3CC4=CC=C(C=C4)Br)N

Isomeric SMILES

COC1=NC(=NC=C1C(=O)NC2CC3CCC(C2)N3CC4=CC=C(C=C4)Br)N

InChI

InChI=1S/C20H24BrN5O2/c1-28-19-17(10-23-20(22)25-19)18(27)24-14-8-15-6-7-16(9-14)26(15)11-12-2-4-13(21)5-3-12/h2-5,10,14-16H,6-9,11H2,1H3,(H,24,27)(H2,22,23,25)