4-[2-[2-(4-bromophenyl)ethanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-[2-(4-bromophenyl)ethanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-[[2-(4-bromophenyl)acetyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[[2-(4-bromophenyl)-1-oxoethyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-[[2-(4-bromophenyl)acetyl]amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-[[2-(4-bromophenyl)acetyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C16H13BrN4O2S MolecularWeight: 405.26902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)N)Br

Isomeric SMILES

C1=CC(=CC=C1CC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)N)Br

InChI

InChI=1S/C16H13BrN4O2S/c17-11-3-1-9(2-4-11)5-14(22)21-16-20-13(8-24-16)10-6-12(15(18)23)19-7-10/h1-4,6-8,19H,5H2,(H2,18,23)(H,20,21,22)