(2R)-2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-1-morpholin-4-yl-propan-1-one

Systemtic Name: (2R)-2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-1-morpholin-4-yl-propan-1-one Openeye Name: (2R)-2-(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanyl-1-morpholino-propan-1-one CAS Name: (2R)-2-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]-1-(4-morpholinyl)-1-propanone IUPAC Name: (2R)-2-(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanyl-1-morpholin-4-ylpropan-1-one Traditional Name: (2R)-2-[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]-1-morpholino-propan-1-one Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)SC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

Isomeric SMILES

C[C@H](C(=O)N1CCOCC1)SC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-15(20(26)24-9-11-27-12-10-24)28-21-23-18-13-17(22)7-8-19(18)25(21)14-16-5-3-2-4-6-16/h2-8,13,15H,9-12,14H2,1H3/t15-/m1/s1