N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-(cyclooctylamino)ethanamide

Systemtic Name: N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-(cyclooctylamino)ethanamide Openeye Name: N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-2-(cyclooctylamino)acetamide CAS Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-butyl-2-(cyclooctylamino)acetamide IUPAC Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butyl-2-(cyclooctylamino)acetamide Traditional Name: N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-2-(cyclooctylamino)acetamide Formula: C22H39N5O3 MolecularWeight: 421.57676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)CNC2CCCCCCC2

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)CNC2CCCCCCC2

InChI

InChI=1S/C22H39N5O3/c1-4-5-13-26(18(28)14-24-17-11-9-7-6-8-10-12-17)19-20(23)27(15-16(2)3)22(30)25-21(19)29/h16-17,24H,4-15,23H2,1-3H3,(H,25,29,30)