4-chloranyl-N,N-diethyl-3-[(3-methylbutanoylamino)carbamoyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N,N-diethyl-3-[(3-methylbutanoylamino)carbamoyl]benzenesulfonamide Openeye Name: 4-chloro-N,N-diethyl-3-[(3-methylbutanoylamino)carbamoyl]benzenesulfonamide CAS Name: 4-chloro-N,N-diethyl-3-[[(3-methyl-1-oxobutyl)hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: 4-chloro-N,N-diethyl-3-[(3-methylbutanoylamino)carbamoyl]benzenesulfonamide Traditional Name: 4-chloro-N,N-diethyl-3-[(isovalerylamino)carbamoyl]benzenesulfonamide Formula: C16H24ClN3O4S MolecularWeight: 389.89746

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NNC(=O)CC(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NNC(=O)CC(C)C

InChI

InChI=1S/C16H24ClN3O4S/c1-5-20(6-2)25(23,24)12-7-8-14(17)13(10-12)16(22)19-18-15(21)9-11(3)4/h7-8,10-11H,5-6,9H2,1-4H3,(H,18,21)(H,19,22)