(2-azanyl-2-oxidanylidene-ethyl)-[[1-(4,6-dimethylpyrimidin-2-yl)pyrrol-2-yl]methyl]azanium

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl)-[[1-(4,6-dimethylpyrimidin-2-yl)pyrrol-2-yl]methyl]azanium Openeye Name: (2-amino-2-oxo-ethyl)-[[1-(4,6-dimethylpyrimidin-2-yl)pyrrol-2-yl]methyl]ammonium CAS Name: (2-amino-2-oxoethyl)-[[1-(4,6-dimethyl-2-pyrimidinyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: (2-amino-2-oxoethyl)-[[1-(4,6-dimethylpyrimidin-2-yl)pyrrol-2-yl]methyl]azanium Traditional Name: (2-amino-2-keto-ethyl)-[[1-(4,6-dimethylpyrimidin-2-yl)pyrrol-2-yl]methyl]ammonium Formula: C13H18N5O+ MolecularWeight: 260.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CC=C2C[NH2+]CC(=O)N)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CC=C2C[NH2+]CC(=O)N)C

InChI

InChI=1S/C13H17N5O/c1-9-6-10(2)17-13(16-9)18-5-3-4-11(18)7-15-8-12(14)19/h3-6,15H,7-8H2,1-2H3,(H2,14,19)/p+1