N-[2-(3,4-dimethylphenyl)sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfanylacetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[(3,4-dimethylphenyl)thio]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfanylacetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[(3,4-dimethylphenyl)thio]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)NC(=O)C2=CC=CN2C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)NC(=O)C2=CC=CN2C)C

InChI

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