3-(2,5-dimethoxyphenyl)-1-[2-(2-methylsulfonylethanoyl)pyrazolidin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(2,5-dimethoxyphenyl)-1-[2-(2-methylsulfonylethanoyl)pyrazolidin-1-yl]prop-2-en-1-one Openeye Name: 3-(2,5-dimethoxyphenyl)-1-[2-(2-methylsulfonylacetyl)pyrazolidin-1-yl]prop-2-en-1-one CAS Name: 3-(2,5-dimethoxyphenyl)-1-[2-(2-methylsulfonyl-1-oxoethyl)-1-pyrazolidinyl]-2-propen-1-one IUPAC Name: 3-(2,5-dimethoxyphenyl)-1-[2-(2-methylsulfonylacetyl)pyrazolidin-1-yl]prop-2-en-1-one Traditional Name: 3-(2,5-dimethoxyphenyl)-1-[2-(2-mesylacetyl)pyrazolidin-1-yl]prop-2-en-1-one Formula: C17H22N2O6S MolecularWeight: 382.43138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)CS(=O)(=O)C

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)CS(=O)(=O)C

InChI

InChI=1S/C17H22N2O6S/c1-24-14-6-7-15(25-2)13(11-14)5-8-16(20)18-9-4-10-19(18)17(21)12-26(3,22)23/h5-8,11H,4,9-10,12H2,1-3H3