1-(1H-indol-3-yl)-2-(phenylmethylsulfanyl)propan-1-one

Systemtic Name: 1-(1H-indol-3-yl)-2-(phenylmethylsulfanyl)propan-1-one Openeye Name: 2-benzylsulfanyl-1-(1H-indol-3-yl)propan-1-one CAS Name: 1-(1H-indol-3-yl)-2-(phenylmethylthio)-1-propanone IUPAC Name: 2-benzylsulfanyl-1-(1H-indol-3-yl)propan-1-one Traditional Name: 2-(benzylthio)-1-(1H-indol-3-yl)propan-1-one Formula: C18H17NOS MolecularWeight: 295.39868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)SCC3=CC=CC=C3

InChI

InChI=1S/C18H17NOS/c1-13(21-12-14-7-3-2-4-8-14)18(20)16-11-19-17-10-6-5-9-15(16)17/h2-11,13,19H,12H2,1H3