N-[4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methyl]phenyl]ethanamide Openeye Name: N-[4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methyl]phenyl]acetamide CAS Name: N-[4-[[4-[(1-methyl-2-imidazolyl)methyl]-1,4-diazepan-1-yl]methyl]phenyl]acetamide IUPAC Name: N-[4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methyl]phenyl]acetamide Traditional Name: N-[4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methyl]phenyl]acetamide Formula: C19H27N5O MolecularWeight: 341.45058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)CC3=NC=CN3C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)CC3=NC=CN3C

InChI

InChI=1S/C19H27N5O/c1-16(25)21-18-6-4-17(5-7-18)14-23-9-3-10-24(13-12-23)15-19-20-8-11-22(19)2/h4-8,11H,3,9-10,12-15H2,1-2H3,(H,21,25)