2-[2-(5-bromanyl-1-benzofuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-(5-bromanyl-1-benzofuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[2-(5-bromobenzofuran-2-yl)-2-oxo-ethyl]sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[[2-(5-bromo-2-benzofuranyl)-2-oxoethyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[2-(5-bromo-1-benzofuran-2-yl)-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-(5-bromobenzofuran-2-yl)-2-keto-ethyl]thio]-N-(p-tolyl)acetamide Formula: C19H16BrNO3S MolecularWeight: 418.30424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)C2=CC3=C(O2)C=CC(=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)C2=CC3=C(O2)C=CC(=C3)Br

InChI

InChI=1S/C19H16BrNO3S/c1-12-2-5-15(6-3-12)21-19(23)11-25-10-16(22)18-9-13-8-14(20)4-7-17(13)24-18/h2-9H,10-11H2,1H3,(H,21,23)