N6-ethyl-N6-phenyl-3-prop-2-enyl-1,4-dihydropyrimidin-3-ium-2,6-diamine iodide

Systemtic Name: N6-ethyl-N6-phenyl-3-prop-2-enyl-1,4-dihydropyrimidin-3-ium-2,6-diamine iodide Openeye Name: 3-allyl-N6-ethyl-N6-phenyl-1,4-dihydropyrimidin-3-ium-2,6-diamine iodide CAS Name: N6-ethyl-N6-phenyl-3-prop-2-enyl-1,4-dihydropyrimidin-3-ium-2,6-diamine iodide IUPAC Name: 6-N-ethyl-6-N-phenyl-3-prop-2-enyl-1,4-dihydropyrimidin-3-ium-2,6-diamine iodide Traditional Name: (3-allyl-2-amino-1,4-dihydropyrimidin-3-ium-6-yl)-ethyl-phenyl-amine iodide Formula: C15H21IN4 MolecularWeight: 384.25851

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC[N+](=C(N1)N)CC=C)C2=CC=CC=C2.[I-]

Isomeric SMILES

CCN(C1=CC[N+](=C(N1)N)CC=C)C2=CC=CC=C2.[I-]

InChI

InChI=1S/C15H20N4.HI/c1-3-11-18-12-10-14(17-15(18)16)19(4-2)13-8-6-5-7-9-13;/h3,5-10H,1,4,11-12H2,2H3,(H2,16,17);1H