4-(1H-benzimidazol-2-ylsulfanyl)-1-morpholin-4-yl-pentan-1-one

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-morpholin-4-yl-pentan-1-one Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-morpholino-pentan-1-one CAS Name: 4-(1H-benzimidazol-2-ylthio)-1-(4-morpholinyl)-1-pentanone IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-morpholin-4-ylpentan-1-one Traditional Name: 4-(1H-benzimidazol-2-ylthio)-1-morpholino-pentan-1-one Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)N1CCOCC1)SC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(CCC(=O)N1CCOCC1)SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H21N3O2S/c1-12(6-7-15(20)19-8-10-21-11-9-19)22-16-17-13-4-2-3-5-14(13)18-16/h2-5,12H,6-11H2,1H3,(H,17,18)