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

Systemtic Name: 4-chloranyl-N,N-dimethyl-3-[(3-methylbutanoylamino)carbamoyl]benzenesulfonamide Openeye Name: 4-chloro-N,N-dimethyl-3-[(3-methylbutanoylamino)carbamoyl]benzenesulfonamide CAS Name: 4-chloro-N,N-dimethyl-3-[[(3-methyl-1-oxobutyl)hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: 4-chloro-N,N-dimethyl-3-[(3-methylbutanoylamino)carbamoyl]benzenesulfonamide Traditional Name: 4-chloro-3-[(isovalerylamino)carbamoyl]-N,N-dimethyl-benzenesulfonamide Formula: C14H20ClN3O4S MolecularWeight: 361.8443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClN3O4S/c1-9(2)7-13(19)16-17-14(20)11-8-10(5-6-12(11)15)23(21,22)18(3)4/h5-6,8-9H,7H2,1-4H3,(H,16,19)(H,17,20)