1-ethyl-N-phenyl-3-(phenylmethyl)imidazol-3-ium-2-carboximidothioate

Systemtic Name: 1-ethyl-N-phenyl-3-(phenylmethyl)imidazol-3-ium-2-carboximidothioate Openeye Name: 1-benzyl-3-ethyl-N-phenyl-imidazol-1-ium-2-carboximidothioate CAS Name: 1-ethyl-N-phenyl-3-(phenylmethyl)-2-imidazol-3-iumcarboximidothioate IUPAC Name: 1-benzyl-3-ethyl-N-phenylimidazol-1-ium-2-carboximidothioate Traditional Name: 1-benzyl-3-ethyl-N-phenyl-imidazol-1-ium-2-carboximidothioate Formula: C19H19N3S MolecularWeight: 321.43926

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C[N+](=C1C(=NC2=CC=CC=C2)[S-])CC3=CC=CC=C3

Isomeric SMILES

CCN1C=C[N+](=C1C(=NC2=CC=CC=C2)[S-])CC3=CC=CC=C3

InChI

InChI=1S/C19H19N3S/c1-2-21-13-14-22(15-16-9-5-3-6-10-16)19(21)18(23)20-17-11-7-4-8-12-17/h3-14H,2,15H2,1H3