N-[2-(2-aminophenyl)sulfanylethanoyl]-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2-(2-aminophenyl)sulfanylethanoyl]-1H-pyrrole-2-carboxamide Openeye Name: N-[2-(2-aminophenyl)sulfanylacetyl]-1H-pyrrole-2-carboxamide CAS Name: N-[2-[(2-aminophenyl)thio]-1-oxoethyl]-1H-pyrrole-2-carboxamide IUPAC Name: N-[2-(2-aminophenyl)sulfanylacetyl]-1H-pyrrole-2-carboxamide Traditional Name: N-[2-[(2-aminophenyl)thio]acetyl]-1H-pyrrole-2-carboxamide Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)SCC(=O)NC(=O)C2=CC=CN2

Isomeric SMILES

C1=CC=C(C(=C1)N)SCC(=O)NC(=O)C2=CC=CN2

InChI

InChI=1S/C13H13N3O2S/c14-9-4-1-2-6-11(9)19-8-12(17)16-13(18)10-5-3-7-15-10/h1-7,15H,8,14H2,(H,16,17,18)