2-[2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanyl-5-(hydroxymethyl)imidazol-1-yl]-N-ethyl-ethanamide

Systemtic Name: 2-[2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanyl-5-(hydroxymethyl)imidazol-1-yl]-N-ethyl-ethanamide Openeye Name: 2-[2-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanyl-5-(hydroxymethyl)imidazol-1-yl]-N-ethyl-acetamide CAS Name: 2-[2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]-5-(hydroxymethyl)-1-imidazolyl]-N-ethylacetamide IUPAC Name: 2-[2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl-5-(hydroxymethyl)imidazol-1-yl]-N-ethylacetamide Traditional Name: 2-[2-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]-5-methylol-imidazol-1-yl]-N-ethyl-acetamide Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CN1C(=CN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)CO

Isomeric SMILES

CCNC(=O)CN1C(=CN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)CO

InChI

InChI=1S/C17H20N4O5S/c1-2-18-15(23)7-21-12(8-22)6-19-17(21)27-9-16(24)20-11-3-4-13-14(5-11)26-10-25-13/h3-6,22H,2,7-10H2,1H3,(H,18,23)(H,20,24)