(phenylmethyl) N-[5-azanyl-6-oxidanylidene-6-(4-pyridin-4-ylpiperazin-1-yl)hexyl]carbamate

Systemtic Name: (phenylmethyl) N-[5-azanyl-6-oxidanylidene-6-(4-pyridin-4-ylpiperazin-1-yl)hexyl]carbamate Openeye Name: benzyl N-[5-amino-6-oxo-6-[4-(4-pyridyl)piperazin-1-yl]hexyl]carbamate CAS Name: N-[5-amino-6-oxo-6-(4-pyridin-4-yl-1-piperazinyl)hexyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[5-amino-6-oxo-6-(4-pyridin-4-ylpiperazin-1-yl)hexyl]carbamate Traditional Name: N-[5-amino-6-keto-6-[4-(4-pyridyl)piperazino]hexyl]carbamic acid benzyl ester Formula: C23H31N5O3 MolecularWeight: 425.52394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C(=O)C(CCCCNC(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C(=O)C(CCCCNC(=O)OCC3=CC=CC=C3)N

InChI

InChI=1S/C23H31N5O3/c24-21(8-4-5-11-26-23(30)31-18-19-6-2-1-3-7-19)22(29)28-16-14-27(15-17-28)20-9-12-25-13-10-20/h1-3,6-7,9-10,12-13,21H,4-5,8,11,14-18,24H2,(H,26,30)