N-phenyl-1,3-bis(phenylmethyl)benzimidazol-3-ium-2-carboximidothioate

Systemtic Name: N-phenyl-1,3-bis(phenylmethyl)benzimidazol-3-ium-2-carboximidothioate Openeye Name: 1,3-dibenzyl-N-phenyl-benzimidazol-3-ium-2-carboximidothioate CAS Name: N-phenyl-1,3-bis(phenylmethyl)-2-benzimidazol-3-iumcarboximidothioate IUPAC Name: 1,3-dibenzyl-N-phenylbenzimidazol-3-ium-2-carboximidothioate Traditional Name: 1,3-dibenzyl-N-phenyl-benzimidazol-3-ium-2-carboximidothioate Formula: C28H23N3S MolecularWeight: 433.56732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3[N+](=C2C(=NC4=CC=CC=C4)[S-])CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3[N+](=C2C(=NC4=CC=CC=C4)[S-])CC5=CC=CC=C5

InChI

InChI=1S/C28H23N3S/c32-27(29-24-16-8-3-9-17-24)28-30(20-22-12-4-1-5-13-22)25-18-10-11-19-26(25)31(28)21-23-14-6-2-7-15-23/h1-19H,20-21H2