3-[(4-bromophenyl)sulfonylamino]-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]propanamide

Systemtic Name: 3-[(4-bromophenyl)sulfonylamino]-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]propanamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-3-[(4-bromophenyl)sulfonylamino]propanamide CAS Name: 3-[(4-bromophenyl)sulfonylamino]-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]propanamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-3-[(4-bromophenyl)sulfonylamino]propanamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-3-(brosylamino)propionamide Formula: C18H20BrN3O4S MolecularWeight: 454.3381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CNC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CNC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H20BrN3O4S/c19-15-6-8-16(9-7-15)27(25,26)22-11-10-17(23)21-13-18(24)20-12-14-4-2-1-3-5-14/h1-9,22H,10-13H2,(H,20,24)(H,21,23)