5-tert-butyl-2-methyl-N-[4-[(3-methylbutanoylamino)carbamoyl]phenyl]benzenesulfonamide

Systemtic Name: 5-tert-butyl-2-methyl-N-[4-[(3-methylbutanoylamino)carbamoyl]phenyl]benzenesulfonamide Openeye Name: 5-tert-butyl-2-methyl-N-[4-[(3-methylbutanoylamino)carbamoyl]phenyl]benzenesulfonamide CAS Name: 5-tert-butyl-2-methyl-N-[4-[[(3-methyl-1-oxobutyl)hydrazo]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 5-tert-butyl-2-methyl-N-[4-[(3-methylbutanoylamino)carbamoyl]phenyl]benzenesulfonamide Traditional Name: 5-tert-butyl-N-[4-[(isovalerylamino)carbamoyl]phenyl]-2-methyl-benzenesulfonamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)CC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)CC(C)C

InChI

InChI=1S/C23H31N3O4S/c1-15(2)13-21(27)24-25-22(28)17-8-11-19(12-9-17)26-31(29,30)20-14-18(23(4,5)6)10-7-16(20)3/h7-12,14-15,26H,13H2,1-6H3,(H,24,27)(H,25,28)