N-[4-[[3-(3,5-dimethoxyphenyl)propanoylamino]carbamoyl]phenyl]thiophene-2-sulfonamide

Systemtic Name: N-[4-[[3-(3,5-dimethoxyphenyl)propanoylamino]carbamoyl]phenyl]thiophene-2-sulfonamide Openeye Name: N-[4-[[3-(3,5-dimethoxyphenyl)propanoylamino]carbamoyl]phenyl]thiophene-2-sulfonamide CAS Name: N-[4-[[[3-(3,5-dimethoxyphenyl)-1-oxopropyl]hydrazo]-oxomethyl]phenyl]-2-thiophenesulfonamide IUPAC Name: N-[4-[[3-(3,5-dimethoxyphenyl)propanoylamino]carbamoyl]phenyl]thiophene-2-sulfonamide Traditional Name: N-[4-[[3-(3,5-dimethoxyphenyl)propanoylamino]carbamoyl]phenyl]thiophene-2-sulfonamide Formula: C22H23N3O6S2 MolecularWeight: 489.56452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)OC

InChI

InChI=1S/C22H23N3O6S2/c1-30-18-12-15(13-19(14-18)31-2)5-10-20(26)23-24-22(27)16-6-8-17(9-7-16)25-33(28,29)21-4-3-11-32-21/h3-4,6-9,11-14,25H,5,10H2,1-2H3,(H,23,26)(H,24,27)