3-[[2-(3,4-dimethoxyphenyl)ethanoylamino]carbamoyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[[2-(3,4-dimethoxyphenyl)ethanoylamino]carbamoyl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[[[2-(3,4-dimethoxyphenyl)acetyl]amino]carbamoyl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]hydrazo]-oxomethyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[[[2-(3,4-dimethoxyphenyl)acetyl]amino]carbamoyl]-N,N-diethylbenzenesulfonamide Traditional Name: N,N-diethyl-3-[(homoveratroylamino)carbamoyl]benzenesulfonamide Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H27N3O6S/c1-5-24(6-2)31(27,28)17-9-7-8-16(14-17)21(26)23-22-20(25)13-15-10-11-18(29-3)19(12-15)30-4/h7-12,14H,5-6,13H2,1-4H3,(H,22,25)(H,23,26)