N-(5-bromanylpyrimidin-2-yl)-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-(5-bromanylpyrimidin-2-yl)-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-(5-bromopyrimidin-2-yl)-2-(8-quinolylsulfanyl)acetamide CAS Name: N-(5-bromo-2-pyrimidinyl)-2-(8-quinolinylthio)acetamide IUPAC Name: N-(5-bromopyrimidin-2-yl)-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-(5-bromopyrimidin-2-yl)-2-(8-quinolylthio)acetamide Formula: C15H11BrN4OS MolecularWeight: 375.24304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SCC(=O)NC3=NC=C(C=N3)Br)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)SCC(=O)NC3=NC=C(C=N3)Br)N=CC=C2

InChI

InChI=1S/C15H11BrN4OS/c16-11-7-18-15(19-8-11)20-13(21)9-22-12-5-1-3-10-4-2-6-17-14(10)12/h1-8H,9H2,(H,18,19,20,21)