N-[5-[[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]carbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[5-[[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]carbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]carbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[5-[[[(4-bromo-1H-pyrrol-2-yl)-oxomethyl]hydrazo]-oxomethyl]-2-chlorophenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]carbamoyl]-2-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[5-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]carbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide Formula: C17H12BrClN4O3S MolecularWeight: 467.72418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NNC(=O)C3=CC(=CN3)Br)Cl

Isomeric SMILES

C1=CSC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NNC(=O)C3=CC(=CN3)Br)Cl

InChI

InChI=1S/C17H12BrClN4O3S/c18-10-7-13(20-8-10)16(25)23-22-15(24)9-3-4-11(19)12(6-9)21-17(26)14-2-1-5-27-14/h1-8,20H,(H,21,26)(H,22,24)(H,23,25)