N-[3-acetamido-5-[[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]carbamoyl]phenyl]ethanamide

Systemtic Name: N-[3-acetamido-5-[[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]carbamoyl]phenyl]ethanamide Openeye Name: N-[3-acetamido-5-[[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]carbamoyl]phenyl]acetamide CAS Name: N-[3-acetamido-5-[[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]hydrazo]-oxomethyl]phenyl]acetamide IUPAC Name: N-[3-acetamido-5-[[(4-bromo-1-methylpyrrole-2-carbonyl)amino]carbamoyl]phenyl]acetamide Traditional Name: N-[3-acetamido-5-[[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]carbamoyl]phenyl]acetamide Formula: C17H18BrN5O4 MolecularWeight: 436.25992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)NNC(=O)C2=CC(=CN2C)Br)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)NNC(=O)C2=CC(=CN2C)Br)NC(=O)C

InChI

InChI=1S/C17H18BrN5O4/c1-9(24)19-13-4-11(5-14(7-13)20-10(2)25)16(26)21-22-17(27)15-6-12(18)8-23(15)3/h4-8H,1-3H3,(H,19,24)(H,20,25)(H,21,26)(H,22,27)