4-[2-[4-[2-(4-methyl-3-oxidanyl-phenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]ethoxy]-1,3-dihydrobenzimidazole-2-thione

Systemtic Name: 4-[2-[4-[2-(4-methyl-3-oxidanyl-phenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]ethoxy]-1,3-dihydrobenzimidazole-2-thione Openeye Name: 4-[2-[4-[2-(3-hydroxy-4-methyl-phenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]ethoxy]-1,3-dihydrobenzimidazole-2-thione CAS Name: 4-[2-[4-[2-(3-hydroxy-4-methylphenyl)-1H-benzimidazol-4-yl]-1-piperazinyl]ethoxy]-1,3-dihydrobenzimidazole-2-thione IUPAC Name: 4-[2-[4-[2-(3-hydroxy-4-methylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]ethoxy]-1,3-dihydrobenzimidazole-2-thione Traditional Name: 4-[2-[4-[2-(3-hydroxy-4-methyl-phenyl)-1H-benzimidazol-4-yl]piperazino]ethoxy]-1,3-dihydrobenzimidazole-2-thione Formula: C27H28N6O2S MolecularWeight: 500.61522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(N2)C=CC=C3N4CCN(CC4)CCOC5=CC=CC6=C5NC(=S)N6)O

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(N2)C=CC=C3N4CCN(CC4)CCOC5=CC=CC6=C5NC(=S)N6)O

InChI

InChI=1S/C27H28N6O2S/c1-17-8-9-18(16-22(17)34)26-28-19-4-2-6-21(24(19)30-26)33-12-10-32(11-13-33)14-15-35-23-7-3-5-20-25(23)31-27(36)29-20/h2-9,16,34H,10-15H2,1H3,(H,28,30)(H2,29,31,36)