N-[2-(4-azanyl-2-fluoranyl-phenyl)sulfanylethanoyl]-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2-(4-azanyl-2-fluoranyl-phenyl)sulfanylethanoyl]-1H-pyrrole-2-carboxamide Openeye Name: N-[2-(4-amino-2-fluoro-phenyl)sulfanylacetyl]-1H-pyrrole-2-carboxamide CAS Name: N-[2-[(4-amino-2-fluorophenyl)thio]-1-oxoethyl]-1H-pyrrole-2-carboxamide IUPAC Name: N-[2-(4-amino-2-fluorophenyl)sulfanylacetyl]-1H-pyrrole-2-carboxamide Traditional Name: N-[2-[(4-amino-2-fluoro-phenyl)thio]acetyl]-1H-pyrrole-2-carboxamide Formula: C13H12FN3O2S MolecularWeight: 293.316683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1)C(=O)NC(=O)CSC2=C(C=C(C=C2)N)F

Isomeric SMILES

C1=CNC(=C1)C(=O)NC(=O)CSC2=C(C=C(C=C2)N)F

InChI

InChI=1S/C13H12FN3O2S/c14-9-6-8(15)3-4-11(9)20-7-12(18)17-13(19)10-2-1-5-16-10/h1-6,16H,7,15H2,(H,17,18,19)