2-[4-[6-chloranyl-2-(2-methyl-1-morpholin-4-yl-propan-2-yl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[6-chloranyl-2-(2-methyl-1-morpholin-4-yl-propan-2-yl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[6-chloro-2-(1,1-dimethyl-2-morpholino-ethyl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[6-chloro-2-[[2-methyl-1-(4-morpholinyl)propan-2-yl]thio]-1H-benzimidazol-5-yl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[6-chloro-2-(2-methyl-1-morpholin-4-ylpropan-2-yl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[6-chloro-2-[(1,1-dimethyl-2-morpholino-ethyl)thio]-1H-benzimidazol-5-yl]piperazino]ethanol Formula: C21H32ClN5O2S MolecularWeight: 454.02908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCOCC1)SC2=NC3=CC(=C(C=C3N2)Cl)N4CCN(CC4)CCO

Isomeric SMILES

CC(C)(CN1CCOCC1)SC2=NC3=CC(=C(C=C3N2)Cl)N4CCN(CC4)CCO

InChI

InChI=1S/C21H32ClN5O2S/c1-21(2,15-26-8-11-29-12-9-26)30-20-23-17-13-16(22)19(14-18(17)24-20)27-5-3-25(4-6-27)7-10-28/h13-14,28H,3-12,15H2,1-2H3,(H,23,24)