N-(5-chloranyl-2-cyano-phenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-(1H-perimidin-2-ylthio)acetamide Formula: C20H13ClN4OS MolecularWeight: 392.86142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)NC(=NC3=CC=C2)SCC(=O)NC4=C(C=CC(=C4)Cl)C#N

Isomeric SMILES

C1=CC2=C3C(=C1)NC(=NC3=CC=C2)SCC(=O)NC4=C(C=CC(=C4)Cl)C#N

InChI

InChI=1S/C20H13ClN4OS/c21-14-8-7-13(10-22)17(9-14)23-18(26)11-27-20-24-15-5-1-3-12-4-2-6-16(25-20)19(12)15/h1-9H,11H2,(H,23,26)(H,24,25)