2-[4-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)piperazin-1-yl]ethylazanium

Systemtic Name: 2-[4-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)piperazin-1-yl]ethylazanium Openeye Name: 2-[4-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)piperazin-1-yl]ethylammonium CAS Name: 2-[4-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-1-piperazinyl]ethylammonium IUPAC Name: 2-[4-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)piperazin-1-yl]ethylazanium Traditional Name: 2-[4-(4-keto-6-phenyl-1H-pyrimidin-2-yl)piperazino]ethylammonium Formula: C16H22N5O+ MolecularWeight: 300.37878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC[NH3+])C2=NC(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC[NH3+])C2=NC(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C16H21N5O/c17-6-7-20-8-10-21(11-9-20)16-18-14(12-15(22)19-16)13-4-2-1-3-5-13/h1-5,12H,6-11,17H2,(H,18,19,22)/p+1