2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(5-chloranyl-2-phenoxy-phenyl)ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(5-chloranyl-2-phenoxy-phenyl)ethanamide Openeye Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]-N-(5-chloro-2-phenoxy-phenyl)acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]-N-(5-chloro-2-phenoxyphenyl)acetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl-N-(5-chloro-2-phenoxyphenyl)acetamide Traditional Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)thio]-N-(5-chloro-2-phenoxy-phenyl)acetamide Formula: C21H14ClN5O2S MolecularWeight: 435.88616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

InChI

InChI=1S/C21H14ClN5O2S/c22-15-6-7-18(29-16-4-2-1-3-5-16)17(9-15)26-19(28)12-30-21-14(11-24)8-13(10-23)20(25)27-21/h1-9H,12H2,(H2,25,27)(H,26,28)