3-[[3-(2,3-dimethylphenoxy)propanoylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-[[3-(2,3-dimethylphenoxy)propanoylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[[3-(2,3-dimethylphenoxy)propanoylamino]carbamoyl]benzenesulfonamide CAS Name: 3-[[[3-(2,3-dimethylphenoxy)-1-oxopropyl]hydrazo]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[3-(2,3-dimethylphenoxy)propanoylamino]carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-3-[[3-(2,3-dimethylphenoxy)propanoylamino]carbamoyl]benzenesulfonamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCCC(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCCC(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C25H27N3O5S/c1-18-8-6-13-23(19(18)2)33-15-14-24(29)27-28-25(30)21-11-7-12-22(16-21)34(31,32)26-17-20-9-4-3-5-10-20/h3-13,16,26H,14-15,17H2,1-2H3,(H,27,29)(H,28,30)