N-[(5-methylfuran-2-yl)methylideneamino]-2-[[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanamide

Systemtic Name: N-[(5-methylfuran-2-yl)methylideneamino]-2-[[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanamide Openeye Name: N-[(5-methyl-2-furyl)methyleneamino]-2-[[3-(p-tolylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetamide CAS Name: N-[(5-methyl-2-furanyl)methylideneamino]-2-[[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]thio]acetamide IUPAC Name: N-[(5-methylfuran-2-yl)methylideneamino]-2-[[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetamide Traditional Name: 2-[[3-(4-methylbenzyl)-1H-benzimidazol-3-ium-2-yl]thio]-N-[(5-methyl-2-furyl)methyleneamino]acetamide Formula: C23H23N4O2S+ MolecularWeight: 419.51932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)NN=CC4=CC=C(O4)C

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)NN=CC4=CC=C(O4)C

InChI

InChI=1S/C23H22N4O2S/c1-16-7-10-18(11-8-16)14-27-21-6-4-3-5-20(21)25-23(27)30-15-22(28)26-24-13-19-12-9-17(2)29-19/h3-13H,14-15H2,1-2H3,(H,26,28)/p+1