4-ethanoyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-methyl-N-[[4-(methylthio)phenyl]methyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-methyl-N-[4-(methylthio)benzyl]-1H-pyrrole-2-carboxamide Formula: C16H18N2O2S MolecularWeight: 302.39132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)N(C)CC2=CC=C(C=C2)SC

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)N(C)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C16H18N2O2S/c1-11(19)13-8-15(17-9-13)16(20)18(2)10-12-4-6-14(21-3)7-5-12/h4-9,17H,10H2,1-3H3