4-ethanoyl-3,5-dimethyl-N-(3-methylsulfanylphenyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-3,5-dimethyl-N-(3-methylsulfanylphenyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-3,5-dimethyl-N-(3-methylsulfanylphenyl)-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-3,5-dimethyl-N-[3-(methylthio)phenyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-3,5-dimethyl-N-(3-methylsulfanylphenyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-3,5-dimethyl-N-[3-(methylthio)phenyl]-1H-pyrrole-2-carboxamide Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=CC(=CC=C2)SC

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C16H18N2O2S/c1-9-14(11(3)19)10(2)17-15(9)16(20)18-12-6-5-7-13(8-12)21-4/h5-8,17H,1-4H3,(H,18,20)