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

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-[5-(hydroxymethyl)-1-prop-2-enyl-imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-allyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(2,5-dimethoxyphenyl)acetamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[[5-(hydroxymethyl)-1-prop-2-enyl-2-imidazolyl]thio]acetamide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-[5-(hydroxymethyl)-1-prop-2-enylimidazol-2-yl]sulfanylacetamide Traditional Name: 2-[(1-allyl-5-methylol-imidazol-2-yl)thio]-N-(2,5-dimethoxyphenyl)acetamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NC=C(N2CC=C)CO

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NC=C(N2CC=C)CO

InChI

InChI=1S/C17H21N3O4S/c1-4-7-20-12(10-21)9-18-17(20)25-11-16(22)19-14-8-13(23-2)5-6-15(14)24-3/h4-6,8-9,21H,1,7,10-11H2,2-3H3,(H,19,22)