N-(1,3-benzodioxol-5-ylmethyl)-N-[(4-chloranyl-1-methyl-pyrazol-3-yl)methyl]-2-methylsulfonyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(4-chloranyl-1-methyl-pyrazol-3-yl)methyl]-2-methylsulfonyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-2-methylsulfonyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(4-chloro-1-methyl-3-pyrazolyl)methyl]-2-methylsulfonylacetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(4-chloro-1-methylpyrazol-3-yl)methyl]-2-methylsulfonylacetamide Traditional Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-2-mesyl-N-piperonyl-acetamide Formula: C16H18ClN3O5S MolecularWeight: 399.84922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CS(=O)(=O)C)Cl

Isomeric SMILES

CN1C=C(C(=N1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CS(=O)(=O)C)Cl

InChI

InChI=1S/C16H18ClN3O5S/c1-19-7-12(17)13(18-19)8-20(16(21)9-26(2,22)23)6-11-3-4-14-15(5-11)25-10-24-14/h3-5,7H,6,8-10H2,1-2H3