N-(cyanomethyl)-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-(cyanomethyl)-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-(cyanomethyl)-2-(8-quinolylsulfanyl)acetamide CAS Name: N-(cyanomethyl)-2-(8-quinolinylthio)acetamide IUPAC Name: N-(cyanomethyl)-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-(cyanomethyl)-2-(8-quinolylthio)acetamide Formula: C13H11N3OS MolecularWeight: 257.31094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SCC(=O)NCC#N)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)SCC(=O)NCC#N)N=CC=C2

InChI

InChI=1S/C13H11N3OS/c14-6-8-15-12(17)9-18-11-5-1-3-10-4-2-7-16-13(10)11/h1-5,7H,8-9H2,(H,15,17)