N-(3,5-dimethylphenyl)-2-[5-(hydroxymethyl)-1-prop-2-enyl-imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-[5-(hydroxymethyl)-1-prop-2-enyl-imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-allyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(3,5-dimethylphenyl)acetamide CAS Name: N-(3,5-dimethylphenyl)-2-[[5-(hydroxymethyl)-1-prop-2-enyl-2-imidazolyl]thio]acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-[5-(hydroxymethyl)-1-prop-2-enylimidazol-2-yl]sulfanylacetamide Traditional Name: 2-[(1-allyl-5-methylol-imidazol-2-yl)thio]-N-(3,5-dimethylphenyl)acetamide Formula: C17H21N3O2S MolecularWeight: 331.43254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CSC2=NC=C(N2CC=C)CO)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CSC2=NC=C(N2CC=C)CO)C

InChI

InChI=1S/C17H21N3O2S/c1-4-5-20-15(10-21)9-18-17(20)23-11-16(22)19-14-7-12(2)6-13(3)8-14/h4,6-9,21H,1,5,10-11H2,2-3H3,(H,19,22)