4-[[6-chloranyl-5-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2-methyl-hexan-2-ol

Systemtic Name: 4-[[6-chloranyl-5-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2-methyl-hexan-2-ol Openeye Name: 4-[[6-chloro-5-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2-methyl-hexan-2-ol CAS Name: 4-[[6-chloro-5-[4-(2-hydroxyethyl)-1-piperazinyl]-1H-benzimidazol-2-yl]thio]-2-methyl-2-hexanol IUPAC Name: 4-[[6-chloro-5-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2-methylhexan-2-ol Traditional Name: 4-[[6-chloro-5-[4-(2-hydroxyethyl)piperazino]-1H-benzimidazol-2-yl]thio]-2-methyl-hexan-2-ol Formula: C20H31ClN4O2S MolecularWeight: 427.00374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)(C)O)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCN(CC3)CCO

Isomeric SMILES

CCC(CC(C)(C)O)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCN(CC3)CCO

InChI

InChI=1S/C20H31ClN4O2S/c1-4-14(13-20(2,3)27)28-19-22-16-11-15(21)18(12-17(16)23-19)25-7-5-24(6-8-25)9-10-26/h11-12,14,26-27H,4-10,13H2,1-3H3,(H,22,23)