4-ethanoyl-N-(2-phenylsulfanylethyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-N-(2-phenylsulfanylethyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-(2-phenylsulfanylethyl)-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[2-(phenylthio)ethyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-(2-phenylsulfanylethyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[2-(phenylthio)ethyl]-1H-pyrrole-2-carboxamide Formula: C15H16N2O2S MolecularWeight: 288.36474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C15H16N2O2S/c1-11(18)12-9-14(17-10-12)15(19)16-7-8-20-13-5-3-2-4-6-13/h2-6,9-10,17H,7-8H2,1H3,(H,16,19)