1,3-dimethyl-N-phenyl-benzimidazol-3-ium-2-carboximidothioate

Systemtic Name: 1,3-dimethyl-N-phenyl-benzimidazol-3-ium-2-carboximidothioate Openeye Name: 1,3-dimethyl-N-phenyl-benzimidazol-3-ium-2-carboximidothioate CAS Name: 1,3-dimethyl-N-phenyl-2-benzimidazol-3-iumcarboximidothioate IUPAC Name: 1,3-dimethyl-N-phenylbenzimidazol-3-ium-2-carboximidothioate Traditional Name: 1,3-dimethyl-N-phenyl-benzimidazol-3-ium-2-carboximidothioate Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2[N+](=C1C(=NC3=CC=CC=C3)[S-])C

Isomeric SMILES

CN1C2=CC=CC=C2[N+](=C1C(=NC3=CC=CC=C3)[S-])C

InChI

InChI=1S/C16H15N3S/c1-18-13-10-6-7-11-14(13)19(2)16(18)15(20)17-12-8-4-3-5-9-12/h3-11H,1-2H3