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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[5-(hydroxymethyl)-1-prop-2-enyl-imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-allyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[5-(hydroxymethyl)-1-prop-2-enyl-2-imidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[5-(hydroxymethyl)-1-prop-2-enylimidazol-2-yl]sulfanylacetamide Traditional Name: 2-[(1-allyl-5-methylol-imidazol-2-yl)thio]-N-(1,3-benzodioxol-5-yl)acetamide Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=CN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)CO

Isomeric SMILES

C=CCN1C(=CN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)CO

InChI

InChI=1S/C16H17N3O4S/c1-2-5-19-12(8-20)7-17-16(19)24-9-15(21)18-11-3-4-13-14(6-11)23-10-22-13/h2-4,6-7,20H,1,5,8-10H2,(H,18,21)