N-(1,3-benzodioxol-5-ylmethyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: 2-[(1-methylimidazol-2-yl)thio]-N-piperonyl-acetamide Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C=CN=C1SCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H15N3O3S/c1-17-5-4-15-14(17)21-8-13(18)16-7-10-2-3-11-12(6-10)20-9-19-11/h2-6H,7-9H2,1H3,(H,16,18)