3-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-4-oxidanyl-1-phenyl-pentan-1-one

Systemtic Name: 3-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-4-oxidanyl-1-phenyl-pentan-1-one Openeye Name: 3-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-4-hydroxy-1-phenyl-pentan-1-one CAS Name: 3-[3-(1H-benzimidazol-2-ylthio)propoxy]-4-hydroxy-1-phenyl-1-pentanone IUPAC Name: 3-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-4-hydroxy-1-phenylpentan-1-one Traditional Name: 3-[3-(1H-benzimidazol-2-ylthio)propoxy]-4-hydroxy-1-phenyl-pentan-1-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC(=O)C1=CC=CC=C1)OCCCSC2=NC3=CC=CC=C3N2)O

Isomeric SMILES

CC(C(CC(=O)C1=CC=CC=C1)OCCCSC2=NC3=CC=CC=C3N2)O

InChI

InChI=1S/C21H24N2O3S/c1-15(24)20(14-19(25)16-8-3-2-4-9-16)26-12-7-13-27-21-22-17-10-5-6-11-18(17)23-21/h2-6,8-11,15,20,24H,7,12-14H2,1H3,(H,22,23)