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

Systemtic Name: ethyl 2-(naphthalen-2-ylmethylsulfanyl)-1-(phenylmethyl)benzimidazole-5-carboxylate Openeye Name: ethyl 1-benzyl-2-(2-naphthylmethylsulfanyl)benzimidazole-5-carboxylate CAS Name: 2-(2-naphthalenylmethylthio)-1-(phenylmethyl)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-2-(naphthalen-2-ylmethylsulfanyl)benzimidazole-5-carboxylate Traditional Name: 1-benzyl-2-(2-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=CC4=CC=CC=C4C=C3)CC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC4=CC=CC=C4C=C3)CC5=CC=CC=C5

InChI

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