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

Systemtic Name: N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)ethanamide Openeye Name: N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)acetamide CAS Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-butyl-2-(5-ethyl-2-methyl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butyl-2-(5-ethyl-2-methylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)acetamide Formula: C22H34N5O3+ MolecularWeight: 416.53706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)C[N+]2=C(C=CC(=C2)CC)C

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)C[N+]2=C(C=CC(=C2)CC)C

InChI

InChI=1S/C22H33N5O3/c1-6-8-11-26(18(28)14-25-13-17(7-2)10-9-16(25)5)19-20(23)27(12-15(3)4)22(30)24-21(19)29/h9-10,13,15H,6-8,11-12,14H2,1-5H3,(H2-,23,24,29,30)/p+1