3-[[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]carbamoyl]-4-methyl-benzenesulfonamide

Systemtic Name: 3-[[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]carbamoyl]-4-methyl-benzenesulfonamide Openeye Name: 3-[[4-(4-chloro-2-methyl-phenoxy)butanoylamino]carbamoyl]-4-methyl-benzenesulfonamide CAS Name: 3-[[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]hydrazo]-oxomethyl]-4-methylbenzenesulfonamide IUPAC Name: 3-[[4-(4-chloro-2-methylphenoxy)butanoylamino]carbamoyl]-4-methylbenzenesulfonamide Traditional Name: 3-[[4-(4-chloro-2-methyl-phenoxy)butanoylamino]carbamoyl]-4-methyl-benzenesulfonamide Formula: C19H22ClN3O5S MolecularWeight: 439.91308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C19H22ClN3O5S/c1-12-5-7-15(29(21,26)27)11-16(12)19(25)23-22-18(24)4-3-9-28-17-8-6-14(20)10-13(17)2/h5-8,10-11H,3-4,9H2,1-2H3,(H,22,24)(H,23,25)(H2,21,26,27)