1,3-diethyl-N-phenyl-imidazol-1-ium-2-carbothioamide

Systemtic Name: 1,3-diethyl-N-phenyl-imidazol-1-ium-2-carbothioamide Openeye Name: 1,3-diethyl-N-phenyl-imidazol-1-ium-2-carbothioamide CAS Name: 1,3-diethyl-N-phenyl-2-imidazol-1-iumcarbothioamide IUPAC Name: 1,3-diethyl-N-phenylimidazol-1-ium-2-carbothioamide Traditional Name: 1,3-diethyl-N-phenyl-imidazol-1-ium-2-carbothioamide Formula: C14H18N3S+ MolecularWeight: 260.37782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3S/c1-3-16-10-11-17(4-2)14(16)13(18)15-12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3/p+1