N-(2-chlorophenyl)-2-(3-cyano-4,6-dimethyl-5-phenyldiazenyl-pyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-(3-cyano-4,6-dimethyl-5-phenyldiazenyl-pyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chlorophenyl)-2-[(3-cyano-4,6-dimethyl-5-phenylazo-2-pyridyl)sulfanyl]acetamide CAS Name: N-(2-chlorophenyl)-2-[(3-cyano-4,6-dimethyl-5-phenyldiazenyl-2-pyridinyl)thio]acetamide IUPAC Name: N-(2-chlorophenyl)-2-(3-cyano-4,6-dimethyl-5-phenyldiazenylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(2-chlorophenyl)-2-[(3-cyano-4,6-dimethyl-5-phenylazo-2-pyridyl)thio]acetamide Formula: C22H18ClN5OS MolecularWeight: 435.92922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1N=NC2=CC=CC=C2)C)SCC(=O)NC3=CC=CC=C3Cl)C#N

Isomeric SMILES

CC1=C(C(=NC(=C1N=NC2=CC=CC=C2)C)SCC(=O)NC3=CC=CC=C3Cl)C#N

InChI

InChI=1S/C22H18ClN5OS/c1-14-17(12-24)22(30-13-20(29)26-19-11-7-6-10-18(19)23)25-15(2)21(14)28-27-16-8-4-3-5-9-16/h3-11H,13H2,1-2H3,(H,26,29)