4-bromanyl-N-(2-methoxyethyl)-3-[(2-phenylethanoylamino)carbamoyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(2-methoxyethyl)-3-[(2-phenylethanoylamino)carbamoyl]benzenesulfonamide Openeye Name: 4-bromo-N-(2-methoxyethyl)-3-[[(2-phenylacetyl)amino]carbamoyl]benzenesulfonamide CAS Name: 4-bromo-N-(2-methoxyethyl)-3-[oxo-[(1-oxo-2-phenylethyl)hydrazo]methyl]benzenesulfonamide IUPAC Name: 4-bromo-N-(2-methoxyethyl)-3-[[(2-phenylacetyl)amino]carbamoyl]benzenesulfonamide Traditional Name: 4-bromo-N-(2-methoxyethyl)-3-[[(2-phenylacetyl)amino]carbamoyl]benzenesulfonamide Formula: C18H20BrN3O5S MolecularWeight: 470.3375

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Descriptors Computed from Structure

Canonical SMILES:

COCCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)NNC(=O)CC2=CC=CC=C2

Isomeric SMILES

COCCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)NNC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H20BrN3O5S/c1-27-10-9-20-28(25,26)14-7-8-16(19)15(12-14)18(24)22-21-17(23)11-13-5-3-2-4-6-13/h2-8,12,20H,9-11H2,1H3,(H,21,23)(H,22,24)