N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]acetamide Traditional Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]-N-piperonyl-acetamide Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)SCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C(=NN1)C)SCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H17N3O3S/c1-9-15(10(2)18-17-9)22-7-14(19)16-6-11-3-4-12-13(5-11)21-8-20-12/h3-5H,6-8H2,1-2H3,(H,16,19)(H,17,18)