N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(1-cyclopropylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(1-cyclopropylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(1-cyclopropylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-[(1-cyclopropyl-2-imidazolyl)thio]acetamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(1-cyclopropylimidazol-2-yl)sulfanylacetamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-[(1-cyclopropylimidazol-2-yl)thio]acetamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CSC3=NC=CN3C4CC4

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CSC3=NC=CN3C4CC4

InChI

InChI=1S/C17H19N3O3S/c1-11(12-2-5-14-15(8-12)23-10-22-14)19-16(21)9-24-17-18-6-7-20(17)13-3-4-13/h2,5-8,11,13H,3-4,9-10H2,1H3,(H,19,21)