2-[4-[5-cyano-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-[5-cyano-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-(5-cyano-1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-(5-cyano-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-1-piperazin-1-iumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-(5-cyano-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperazin-1-ium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-(5-cyano-2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide Formula: C16H23N6O3+ MolecularWeight: 347.39222

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)N2CC[NH+](CC2)CC(=O)NC3CC3

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)N2CC[NH+](CC2)CC(=O)NC3CC3

InChI

InChI=1S/C16H22N6O3/c1-19-14(12(9-17)15(24)20(2)16(19)25)22-7-5-21(6-8-22)10-13(23)18-11-3-4-11/h11H,3-8,10H2,1-2H3,(H,18,23)/p+1