2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Systemtic Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C18H21NO2S2 MolecularWeight: 347.49484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)COC2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)COC2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C18H21NO2S2/c1-12-10-16(13(2)19(12)3)17(20)11-21-15-6-4-14(5-7-15)18-22-8-9-23-18/h4-7,10,18H,8-9,11H2,1-3H3