1-(2-methoxyphenyl)-2-[2-(4-methylphenoxy)ethylsulfanyl]-5-nitro-benzimidazole

Systemtic Name: 1-(2-methoxyphenyl)-2-[2-(4-methylphenoxy)ethylsulfanyl]-5-nitro-benzimidazole Openeye Name: 1-(2-methoxyphenyl)-2-[2-(4-methylphenoxy)ethylsulfanyl]-5-nitro-benzimidazole CAS Name: 1-(2-methoxyphenyl)-2-[2-(4-methylphenoxy)ethylthio]-5-nitrobenzimidazole IUPAC Name: 1-(2-methoxyphenyl)-2-[2-(4-methylphenoxy)ethylsulfanyl]-5-nitrobenzimidazole Traditional Name: 1-(2-methoxyphenyl)-2-[2-(4-methylphenoxy)ethylthio]-5-nitro-benzimidazole Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCSC2=NC3=C(N2C4=CC=CC=C4OC)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCCSC2=NC3=C(N2C4=CC=CC=C4OC)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O4S/c1-16-7-10-18(11-8-16)30-13-14-31-23-24-19-15-17(26(27)28)9-12-20(19)25(23)21-5-3-4-6-22(21)29-2/h3-12,15H,13-14H2,1-2H3