4-[[6-chloranyl-5-[4-(phenylmethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2,4-dimethyl-pentan-2-ol

Systemtic Name: 4-[[6-chloranyl-5-[4-(phenylmethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2,4-dimethyl-pentan-2-ol Openeye Name: 4-[[5-(4-benzylpiperazin-1-yl)-6-chloro-1H-benzimidazol-2-yl]sulfanyl]-2,4-dimethyl-pentan-2-ol CAS Name: 4-[[6-chloro-5-[4-(phenylmethyl)-1-piperazinyl]-1H-benzimidazol-2-yl]thio]-2,4-dimethyl-2-pentanol IUPAC Name: 4-[[5-(4-benzylpiperazin-1-yl)-6-chloro-1H-benzimidazol-2-yl]sulfanyl]-2,4-dimethylpentan-2-ol Traditional Name: 4-[[5-(4-benzylpiperazino)-6-chloro-1H-benzimidazol-2-yl]thio]-2,4-dimethyl-pentan-2-ol Formula: C25H33ClN4OS MolecularWeight: 473.07372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C)(C)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCN(CC3)CC4=CC=CC=C4)O

Isomeric SMILES

CC(C)(CC(C)(C)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCN(CC3)CC4=CC=CC=C4)O

InChI

InChI=1S/C25H33ClN4OS/c1-24(2,31)17-25(3,4)32-23-27-20-14-19(26)22(15-21(20)28-23)30-12-10-29(11-13-30)16-18-8-6-5-7-9-18/h5-9,14-15,31H,10-13,16-17H2,1-4H3,(H,27,28)