6-azanyl-1-cyclopropyl-5-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-cyclopropyl-5-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-cyclopropyl-5-[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-cyclopropyl-5-[1-oxo-2-[4-(2-pyridinyl)-1-piperazin-1-iumyl]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-cyclopropyl-5-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-cyclopropyl-5-[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]acetyl]pyrimidine-2,4-quinone Formula: C18H23N6O3+ MolecularWeight: 371.41362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=C(C(=O)NC2=O)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=N4)N

Isomeric SMILES

C1CC1N2C(=C(C(=O)NC2=O)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=N4)N

InChI

InChI=1S/C18H22N6O3/c19-16-15(17(26)21-18(27)24(16)12-4-5-12)13(25)11-22-7-9-23(10-8-22)14-3-1-2-6-20-14/h1-3,6,12H,4-5,7-11,19H2,(H,21,26,27)/p+1