N,N-bis(2-methylbutyl)-3-(4-methyl-3-oxidanylidene-pyrazolidin-1-yl)benzenesulfonamide

Systemtic Name: N,N-bis(2-methylbutyl)-3-(4-methyl-3-oxidanylidene-pyrazolidin-1-yl)benzenesulfonamide Openeye Name: N,N-bis(2-methylbutyl)-3-(4-methyl-3-oxo-pyrazolidin-1-yl)benzenesulfonamide CAS Name: N,N-bis(2-methylbutyl)-3-(4-methyl-3-oxo-1-pyrazolidinyl)benzenesulfonamide IUPAC Name: N,N-bis(2-methylbutyl)-3-(4-methyl-3-oxopyrazolidin-1-yl)benzenesulfonamide Traditional Name: 3-(3-keto-4-methyl-pyrazolidin-1-yl)-N,N-bis(2-methylbutyl)benzenesulfonamide Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN(CC(C)CC)S(=O)(=O)C1=CC=CC(=C1)N2CC(C(=O)N2)C

Isomeric SMILES

CCC(C)CN(CC(C)CC)S(=O)(=O)C1=CC=CC(=C1)N2CC(C(=O)N2)C

InChI

InChI=1S/C20H33N3O3S/c1-6-15(3)12-22(13-16(4)7-2)27(25,26)19-10-8-9-18(11-19)23-14-17(5)20(24)21-23/h8-11,15-17H,6-7,12-14H2,1-5H3,(H,21,24)