N,N-diethyl-3-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoylamino]benzamide

Systemtic Name: N,N-diethyl-3-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoylamino]benzamide Openeye Name: 3-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N,N-diethyl-benzamide CAS Name: N,N-diethyl-3-[[1-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]amino]benzamide IUPAC Name: 3-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N,N-diethyl-benzamide Formula: C25H34N4O2 MolecularWeight: 422.56306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C25H34N4O2/c1-3-29(4-2)25(31)22-12-8-13-23(18-22)26-24(30)20-28-15-9-14-27(16-17-28)19-21-10-6-5-7-11-21/h5-8,10-13,18H,3-4,9,14-17,19-20H2,1-2H3,(H,26,30)