4-[[6-chloranyl-5-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]cyclohexan-1-one

Systemtic Name: 4-[[6-chloranyl-5-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]cyclohexan-1-one Openeye Name: 4-[[6-chloro-5-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]cyclohexanone CAS Name: 4-[[6-chloro-5-[4-(2-hydroxyethyl)-1-piperazinyl]-1H-benzimidazol-2-yl]thio]-1-cyclohexanone IUPAC Name: 4-[[6-chloro-5-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]cyclohexan-1-one Traditional Name: 4-[[6-chloro-5-[4-(2-hydroxyethyl)piperazino]-1H-benzimidazol-2-yl]thio]cyclohexanone Formula: C19H25ClN4O2S MolecularWeight: 408.9454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)CCC1SC2=NC3=CC(=C(C=C3N2)Cl)N4CCN(CC4)CCO

Isomeric SMILES

C1CC(=O)CCC1SC2=NC3=CC(=C(C=C3N2)Cl)N4CCN(CC4)CCO

InChI

InChI=1S/C19H25ClN4O2S/c20-15-11-16-17(12-18(15)24-7-5-23(6-8-24)9-10-25)22-19(21-16)27-14-3-1-13(26)2-4-14/h11-12,14,25H,1-10H2,(H,21,22)