4-tert-butyl-N-[[4-[(3-methylbutanoylamino)carbamoyl]phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[[4-[(3-methylbutanoylamino)carbamoyl]phenyl]methyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[[4-[(3-methylbutanoylamino)carbamoyl]phenyl]methyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[[4-[[(3-methyl-1-oxobutyl)hydrazo]-oxomethyl]phenyl]methyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[[4-[(3-methylbutanoylamino)carbamoyl]phenyl]methyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-[(isovalerylamino)carbamoyl]benzyl]benzenesulfonamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=O)C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)CC(=O)NNC(=O)C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H31N3O4S/c1-16(2)14-21(27)25-26-22(28)18-8-6-17(7-9-18)15-24-31(29,30)20-12-10-19(11-13-20)23(3,4)5/h6-13,16,24H,14-15H2,1-5H3,(H,25,27)(H,26,28)