N-(2-cyanoethyl)-2-phthalazin-1-ylsulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-phthalazin-1-ylsulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-phthalazin-1-ylsulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-2-(1-phthalazinylthio)acetamide IUPAC Name: N-(2-cyanoethyl)-2-phthalazin-1-ylsulfanylacetamide Traditional Name: N-(2-cyanoethyl)-2-(phthalazin-1-ylthio)acetamide Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN=C2SCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C=NN=C2SCC(=O)NCCC#N

InChI

InChI=1S/C13H12N4OS/c14-6-3-7-15-12(18)9-19-13-11-5-2-1-4-10(11)8-16-17-13/h1-2,4-5,8H,3,7,9H2,(H,15,18)