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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-cyclopentyl-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(4-benzoylpiperazin-1-ium-1-yl)-N-cyclopentyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-(4-benzoyl-1-piperazin-1-iumyl)-N-cyclopentylacetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(4-benzoylpiperazin-1-ium-1-yl)-N-cyclopentylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(4-benzoylpiperazin-1-ium-1-yl)-N-cyclopentyl-acetamide Formula: C26H37N6O4+ MolecularWeight: 497.60978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4)N

InChI

InChI=1S/C26H36N6O4/c1-2-3-13-31-23(27)22(24(34)28-26(31)36)32(20-11-7-8-12-20)21(33)18-29-14-16-30(17-15-29)25(35)19-9-5-4-6-10-19/h4-6,9-10,20H,2-3,7-8,11-18,27H2,1H3,(H,28,34,36)/p+1