2-(1,3-benzodioxol-5-yl)-1-[2-(3-chloranyl-4-methylsulfonyl-thiophen-2-yl)carbonylpyrazolidin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(3-chloranyl-4-methylsulfonyl-thiophen-2-yl)carbonylpyrazolidin-1-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(3-chloro-4-methylsulfonyl-thiophene-2-carbonyl)pyrazolidin-1-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yl)-1-[2-[(3-chloro-4-methylsulfonyl-2-thiophenyl)-oxomethyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(3-chloro-4-methylsulfonylthiophene-2-carbonyl)pyrazolidin-1-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(3-chloro-4-mesyl-thiophene-2-carbonyl)pyrazolidin-1-yl]ethanone Formula: C18H17ClN2O6S2 MolecularWeight: 456.92038

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CSC(=C1Cl)C(=O)N2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)C1=CSC(=C1Cl)C(=O)N2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17ClN2O6S2/c1-29(24,25)14-9-28-17(16(14)19)18(23)21-6-2-5-20(21)15(22)8-11-3-4-12-13(7-11)27-10-26-12/h3-4,7,9H,2,5-6,8,10H2,1H3