N-[(3-bromophenyl)methyl]-1-[3-(4-methylphenoxy)pyrazin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-[(3-bromophenyl)methyl]-1-[3-(4-methylphenoxy)pyrazin-2-yl]piperidine-4-carboxamide Openeye Name: N-[(3-bromophenyl)methyl]-1-[3-(4-methylphenoxy)pyrazin-2-yl]piperidine-4-carboxamide CAS Name: N-[(3-bromophenyl)methyl]-1-[3-(4-methylphenoxy)-2-pyrazinyl]-4-piperidinecarboxamide IUPAC Name: N-[(3-bromophenyl)methyl]-1-[3-(4-methylphenoxy)pyrazin-2-yl]piperidine-4-carboxamide Traditional Name: N-(3-bromobenzyl)-1-[3-(4-methylphenoxy)pyrazin-2-yl]isonipecotamide Formula: C24H25BrN4O2 MolecularWeight: 481.3849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=NC=CN=C2N3CCC(CC3)C(=O)NCC4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)OC2=NC=CN=C2N3CCC(CC3)C(=O)NCC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H25BrN4O2/c1-17-5-7-21(8-6-17)31-24-22(26-11-12-27-24)29-13-9-19(10-14-29)23(30)28-16-18-3-2-4-20(25)15-18/h2-8,11-12,15,19H,9-10,13-14,16H2,1H3,(H,28,30)