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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-propan-2-ylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-isopropylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(1-propan-2-yl-2-imidazolyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-propan-2-ylimidazol-2-yl)sulfanylacetamide Traditional Name: 2-[(1-isopropylimidazol-2-yl)thio]-N-piperonyl-acetamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CN=C1SCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)N1C=CN=C1SCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H19N3O3S/c1-11(2)19-6-5-17-16(19)23-9-15(20)18-8-12-3-4-13-14(7-12)22-10-21-13/h3-7,11H,8-10H2,1-2H3,(H,18,20)