1-(1-ethyl-1,2,4-triazol-3-yl)-3-[[4-(2-methyl-1H-imidazol-3-ium-3-yl)phenyl]methyl]urea

Systemtic Name: 1-(1-ethyl-1,2,4-triazol-3-yl)-3-[[4-(2-methyl-1H-imidazol-3-ium-3-yl)phenyl]methyl]urea Openeye Name: 1-(1-ethyl-1,2,4-triazol-3-yl)-3-[[4-(2-methyl-1H-imidazol-3-ium-3-yl)phenyl]methyl]urea CAS Name: 1-(1-ethyl-1,2,4-triazol-3-yl)-3-[[4-(2-methyl-1H-imidazol-3-ium-3-yl)phenyl]methyl]urea IUPAC Name: 1-(1-ethyl-1,2,4-triazol-3-yl)-3-[[4-(2-methyl-1H-imidazol-3-ium-3-yl)phenyl]methyl]urea Traditional Name: 1-(1-ethyl-1,2,4-triazol-3-yl)-3-[4-(2-methyl-1H-imidazol-3-ium-3-yl)benzyl]urea Formula: C16H20N7O+ MolecularWeight: 326.3763

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC(=N1)NC(=O)NCC2=CC=C(C=C2)[N+]3=C(NC=C3)C

Isomeric SMILES

CCN1C=NC(=N1)NC(=O)NCC2=CC=C(C=C2)[N+]3=C(NC=C3)C

InChI

InChI=1S/C16H19N7O/c1-3-22-11-19-15(21-22)20-16(24)18-10-13-4-6-14(7-5-13)23-9-8-17-12(23)2/h4-9,11H,3,10H2,1-2H3,(H2,18,20,21,24)/p+1