N-(2,6-dimethylphenyl)-3-methyl-2-prop-2-ynoxy-4-sulfanylidene-pentanamide

Systemtic Name: N-(2,6-dimethylphenyl)-3-methyl-2-prop-2-ynoxy-4-sulfanylidene-pentanamide Openeye Name: N-(2,6-dimethylphenyl)-3-methyl-2-prop-2-ynoxy-4-thioxo-pentanamide CAS Name: N-(2,6-dimethylphenyl)-3-methyl-2-prop-2-ynoxy-4-sulfanylidenepentanamide IUPAC Name: N-(2,6-dimethylphenyl)-3-methyl-2-prop-2-ynoxy-4-sulfanylidenepentanamide Traditional Name: N-(2,6-dimethylphenyl)-3-methyl-2-propargyloxy-4-thioxo-valeramide Formula: C17H21NO2S MolecularWeight: 303.41914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(C(C)C(=S)C)OCC#C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C(C(C)C(=S)C)OCC#C

InChI

InChI=1S/C17H21NO2S/c1-6-10-20-16(13(4)14(5)21)17(19)18-15-11(2)8-7-9-12(15)3/h1,7-9,13,16H,10H2,2-5H3,(H,18,19)