N-(1,3-benzodioxol-5-yl)-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[4-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(1-benzyl-4-methylol-imidazol-2-yl)thio]acetamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC(=CN3CC4=CC=CC=C4)CO

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC(=CN3CC4=CC=CC=C4)CO

InChI

InChI=1S/C20H19N3O4S/c24-11-16-10-23(9-14-4-2-1-3-5-14)20(22-16)28-12-19(25)21-15-6-7-17-18(8-15)27-13-26-17/h1-8,10,24H,9,11-13H2,(H,21,25)