N-(3-chlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-4,5-dihydro-1H-imidazol-3-ium-3-carboxamide

Systemtic Name: N-(3-chlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-4,5-dihydro-1H-imidazol-3-ium-3-carboxamide Openeye Name: N-(3-chlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-4,5-dihydro-1H-imidazol-3-ium-3-carboxamide CAS Name: N-(3-chlorophenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)amino]-4,5-dihydro-1H-imidazol-3-ium-3-carboxamide IUPAC Name: N-(3-chlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-4,5-dihydro-1H-imidazol-3-ium-3-carboxamide Traditional Name: N-(3-chlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-2-imidazolin-1-ium-1-carboxamide Formula: C16H18ClN6O+ MolecularWeight: 345.80672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=[N+](CCN2)C(=O)NC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=[N+](CCN2)C(=O)NC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C16H17ClN6O/c1-10-8-11(2)20-14(19-10)22-15-18-6-7-23(15)16(24)21-13-5-3-4-12(17)9-13/h3-5,8-9H,6-7H2,1-2H3,(H2,18,19,20,21,22,24)/p+1