3-[[3-(3-chloranyl-4-methyl-phenyl)propanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[3-(3-chloranyl-4-methyl-phenyl)propanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[3-(3-chloro-4-methyl-phenyl)propanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[3-(3-chloro-4-methylphenyl)-1-oxopropyl]hydrazo]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[3-(3-chloro-4-methylphenyl)propanoylamino]carbamoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[3-(3-chloro-4-methyl-phenyl)propanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Formula: C19H22ClN3O4S MolecularWeight: 423.91368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C)Cl

InChI

InChI=1S/C19H22ClN3O4S/c1-13-7-8-14(11-17(13)20)9-10-18(24)21-22-19(25)15-5-4-6-16(12-15)28(26,27)23(2)3/h4-8,11-12H,9-10H2,1-3H3,(H,21,24)(H,22,25)