1-(2-methoxyphenyl)-5-nitro-2-(2-phenoxyethylsulfanyl)benzimidazole

Systemtic Name: 1-(2-methoxyphenyl)-5-nitro-2-(2-phenoxyethylsulfanyl)benzimidazole Openeye Name: 1-(2-methoxyphenyl)-5-nitro-2-(2-phenoxyethylsulfanyl)benzimidazole CAS Name: 1-(2-methoxyphenyl)-5-nitro-2-(2-phenoxyethylthio)benzimidazole IUPAC Name: 1-(2-methoxyphenyl)-5-nitro-2-(2-phenoxyethylsulfanyl)benzimidazole Traditional Name: 1-(2-methoxyphenyl)-5-nitro-2-(2-phenoxyethylthio)benzimidazole Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCCOC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCCOC4=CC=CC=C4

InChI

InChI=1S/C22H19N3O4S/c1-28-21-10-6-5-9-20(21)24-19-12-11-16(25(26)27)15-18(19)23-22(24)30-14-13-29-17-7-3-2-4-8-17/h2-12,15H,13-14H2,1H3