N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-cyclopentyl-2-(4-ethanoylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-cyclopentyl-2-(4-ethanoylpiperazin-1-ium-1-yl)ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-cyclopentyl-acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-cyclopentylacetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-cyclopentylacetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-cyclopentyl-acetamide Formula: C21H35N6O4+ MolecularWeight: 435.5404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)C[NH+]3CCN(CC3)C(=O)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)C[NH+]3CCN(CC3)C(=O)C)N

InChI

InChI=1S/C21H34N6O4/c1-3-4-9-26-19(22)18(20(30)23-21(26)31)27(16-7-5-6-8-16)17(29)14-24-10-12-25(13-11-24)15(2)28/h16H,3-14,22H2,1-2H3,(H,23,30,31)/p+1