hexoxysulfanyl-(2-imidazol-1-yl-1-phenyl-ethyl)sulfanyl-methanone

Systemtic Name: hexoxysulfanyl-(2-imidazol-1-yl-1-phenyl-ethyl)sulfanyl-methanone Openeye Name: hexoxysulfanyl-(2-imidazol-1-yl-1-phenyl-ethyl)sulfanyl-methanone CAS Name: [[2-(1-imidazolyl)-1-phenylethyl]thio]-oxomethanesulfenic acid hexyl ester IUPAC Name: hexoxysulfanyl-(2-imidazol-1-yl-1-phenylethyl)sulfanylmethanone Traditional Name: (hexoxythio)-[(2-imidazol-1-yl-1-phenyl-ethyl)thio]methanone Formula: C18H24N2O2S2 MolecularWeight: 364.52536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOSC(=O)SC(CN1C=CN=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCOSC(=O)SC(CN1C=CN=C1)C2=CC=CC=C2

InChI

InChI=1S/C18H24N2O2S2/c1-2-3-4-8-13-22-24-18(21)23-17(14-20-12-11-19-15-20)16-9-6-5-7-10-16/h5-7,9-12,15,17H,2-4,8,13-14H2,1H3