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

Systemtic Name: 2-[2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanyl-5-(hydroxymethyl)imidazol-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[2-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanyl-5-(hydroxymethyl)imidazol-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]-5-(hydroxymethyl)-1-imidazolyl]-N-cyclopropylacetamide IUPAC Name: 2-[2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl-5-(hydroxymethyl)imidazol-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[2-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]-5-methylol-imidazol-1-yl]-N-cyclopropyl-acetamide Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CN2C(=CN=C2SCC(=O)NC3=CC4=C(C=C3)OCO4)CO

Isomeric SMILES

C1CC1NC(=O)CN2C(=CN=C2SCC(=O)NC3=CC4=C(C=C3)OCO4)CO

InChI

InChI=1S/C18H20N4O5S/c23-8-13-6-19-18(22(13)7-16(24)20-11-1-2-11)28-9-17(25)21-12-3-4-14-15(5-12)27-10-26-14/h3-6,11,23H,1-2,7-10H2,(H,20,24)(H,21,25)