[4-[6-(furan-3-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]phenyl]methyl-methyl-[(5-methyl-1H-imidazol-2-yl)methyl]azanium

Systemtic Name: [4-[6-(furan-3-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]phenyl]methyl-methyl-[(5-methyl-1H-imidazol-2-yl)methyl]azanium Openeye Name: [4-[6-(3-furyl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl-methyl-[(5-methyl-1H-imidazol-2-yl)methyl]ammonium CAS Name: [4-[6-(3-furanyl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl-methyl-[(5-methyl-1H-imidazol-2-yl)methyl]ammonium IUPAC Name: [4-[6-(furan-3-yl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl-methyl-[(5-methyl-1H-imidazol-2-yl)methyl]azanium Traditional Name: [4-[6-(3-furyl)-4-keto-1H-pyrimidin-2-yl]benzyl]-methyl-[(5-methyl-1H-imidazol-2-yl)methyl]ammonium Formula: C21H22N5O2+ MolecularWeight: 376.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N1)C[NH+](C)CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)C4=COC=C4

Isomeric SMILES

CC1=CN=C(N1)C[NH+](C)CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)C4=COC=C4

InChI

InChI=1S/C21H21N5O2/c1-14-10-22-19(23-14)12-26(2)11-15-3-5-16(6-4-15)21-24-18(9-20(27)25-21)17-7-8-28-13-17/h3-10,13H,11-12H2,1-2H3,(H,22,23)(H,24,25,27)/p+1