N-[2-(cyanomethylsulfanyl)phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-(quinazolin-4-ylthio)acetamide Formula: C18H14N4OS2 MolecularWeight: 366.45996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=CC=CC=C3SCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=CC=CC=C3SCC#N

InChI

InChI=1S/C18H14N4OS2/c19-9-10-24-16-8-4-3-7-15(16)22-17(23)11-25-18-13-5-1-2-6-14(13)20-12-21-18/h1-8,12H,10-11H2,(H,22,23)