N-[2-(5-bromanylthiophen-2-yl)ethyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-[2-(5-bromanylthiophen-2-yl)ethyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-[2-(5-bromo-2-thienyl)ethyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-[2-(5-bromo-2-thiophenyl)ethyl]-4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-[2-(5-bromothiophen-2-yl)ethyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-[2-(5-bromo-2-thienyl)ethyl]-4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzamide Formula: C19H19BrN4O2S2 MolecularWeight: 479.41376

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCCC3=CC=C(S3)Br

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCCC3=CC=C(S3)Br

InChI

InChI=1S/C19H19BrN4O2S2/c1-24-11-10-22-19(24)27-12-17(25)23-14-4-2-13(3-5-14)18(26)21-9-8-15-6-7-16(20)28-15/h2-7,10-11H,8-9,12H2,1H3,(H,21,26)(H,23,25)