1-(2-methoxyphenyl)-2-(naphthalen-1-ylmethylsulfanyl)-5-nitro-benzimidazole

Systemtic Name: 1-(2-methoxyphenyl)-2-(naphthalen-1-ylmethylsulfanyl)-5-nitro-benzimidazole Openeye Name: 1-(2-methoxyphenyl)-2-(1-naphthylmethylsulfanyl)-5-nitro-benzimidazole CAS Name: 1-(2-methoxyphenyl)-2-(1-naphthalenylmethylthio)-5-nitrobenzimidazole IUPAC Name: 1-(2-methoxyphenyl)-2-(naphthalen-1-ylmethylsulfanyl)-5-nitrobenzimidazole Traditional Name: 1-(2-methoxyphenyl)-2-(1-naphthylmethylthio)-5-nitro-benzimidazole Formula: C25H19N3O3S MolecularWeight: 441.50166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H19N3O3S/c1-31-24-12-5-4-11-23(24)27-22-14-13-19(28(29)30)15-21(22)26-25(27)32-16-18-9-6-8-17-7-2-3-10-20(17)18/h2-15H,16H2,1H3