N-(2-cyano-3-methyl-butan-2-yl)-2-phthalazin-1-ylsulfanyl-ethanamide

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-phthalazin-1-ylsulfanyl-ethanamide Openeye Name: N-(1-cyano-1,2-dimethyl-propyl)-2-phthalazin-1-ylsulfanyl-acetamide CAS Name: N-(2-cyano-3-methylbutan-2-yl)-2-(1-phthalazinylthio)acetamide IUPAC Name: N-(2-cyano-3-methylbutan-2-yl)-2-phthalazin-1-ylsulfanylacetamide Traditional Name: N-(1-cyano-1,2-dimethyl-propyl)-2-(phthalazin-1-ylthio)acetamide Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CSC1=NN=CC2=CC=CC=C21

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)CSC1=NN=CC2=CC=CC=C21

InChI

InChI=1S/C16H18N4OS/c1-11(2)16(3,10-17)19-14(21)9-22-15-13-7-5-4-6-12(13)8-18-20-15/h4-8,11H,9H2,1-3H3,(H,19,21)