N-[2-(4-bromophenyl)sulfanylethyl]-4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2-(4-bromophenyl)sulfanylethyl]-4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[2-(4-bromophenyl)sulfanylethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[2-[(4-bromophenyl)thio]ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[2-(4-bromophenyl)sulfanylethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[2-[(4-bromophenyl)thio]ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Formula: C17H19BrN2O2S MolecularWeight: 395.31396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NCCSC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NCCSC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H19BrN2O2S/c1-10-15(12(3)21)11(2)20-16(10)17(22)19-8-9-23-14-6-4-13(18)5-7-14/h4-7,20H,8-9H2,1-3H3,(H,19,22)