3-[(4-bromophenyl)sulfonylamino]-N-[4-(prop-2-enylcarbamoylamino)phenyl]propanamide

Systemtic Name: 3-[(4-bromophenyl)sulfonylamino]-N-[4-(prop-2-enylcarbamoylamino)phenyl]propanamide Openeye Name: N-[4-(allylcarbamoylamino)phenyl]-3-[(4-bromophenyl)sulfonylamino]propanamide CAS Name: 3-[(4-bromophenyl)sulfonylamino]-N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]propanamide IUPAC Name: 3-[(4-bromophenyl)sulfonylamino]-N-[4-(prop-2-enylcarbamoylamino)phenyl]propanamide Traditional Name: N-[4-(allylcarbamoylamino)phenyl]-3-(brosylamino)propionamide Formula: C19H21BrN4O4S MolecularWeight: 481.36344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H21BrN4O4S/c1-2-12-21-19(26)24-16-7-5-15(6-8-16)23-18(25)11-13-22-29(27,28)17-9-3-14(20)4-10-17/h2-10,22H,1,11-13H2,(H,23,25)(H2,21,24,26)