ethyl 2-(naphthalen-1-ylmethylsulfanyl)-1-(phenylmethyl)benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-(naphthalen-1-ylmethylsulfanyl)-1-(phenylmethyl)benzimidazole-5-carboxylate Openeye Name: ethyl 1-benzyl-2-(1-naphthylmethylsulfanyl)benzimidazole-5-carboxylate CAS Name: 2-(1-naphthalenylmethylthio)-1-(phenylmethyl)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-2-(naphthalen-1-ylmethylsulfanyl)benzimidazole-5-carboxylate Traditional Name: 1-benzyl-2-(1-naphthylmethylthio)benzimidazole-5-carboxylic acid ethyl ester Formula: C28H24N2O2S MolecularWeight: 452.56736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C28H24N2O2S/c1-2-32-27(31)22-15-16-26-25(17-22)29-28(30(26)18-20-9-4-3-5-10-20)33-19-23-13-8-12-21-11-6-7-14-24(21)23/h3-17H,2,18-19H2,1H3