N-(2,6-diethylphenyl)-2-(5-methylsulfonylthiophen-2-yl)carbonyl-pyrazolidine-1-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-2-(5-methylsulfonylthiophen-2-yl)carbonyl-pyrazolidine-1-carboxamide Openeye Name: N-(2,6-diethylphenyl)-2-(5-methylsulfonylthiophene-2-carbonyl)pyrazolidine-1-carboxamide CAS Name: N-(2,6-diethylphenyl)-2-[(5-methylsulfonyl-2-thiophenyl)-oxomethyl]-1-pyrazolidinecarboxamide IUPAC Name: N-(2,6-diethylphenyl)-2-(5-methylsulfonylthiophene-2-carbonyl)pyrazolidine-1-carboxamide Traditional Name: N-(2,6-diethylphenyl)-2-(5-mesylthiophene-2-carbonyl)pyrazolidine-1-carboxamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=O)C3=CC=C(S3)S(=O)(=O)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=O)C3=CC=C(S3)S(=O)(=O)C

InChI

InChI=1S/C20H25N3O4S2/c1-4-14-8-6-9-15(5-2)18(14)21-20(25)23-13-7-12-22(23)19(24)16-10-11-17(28-16)29(3,26)27/h6,8-11H,4-5,7,12-13H2,1-3H3,(H,21,25)