2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[3,5-bis(chloranyl)phenyl]-2-phenyl-ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[3,5-bis(chloranyl)phenyl]-2-phenyl-ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(3,5-dichlorophenyl)-2-phenyl-acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-(3,5-dichlorophenyl)-2-phenylacetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(3,5-dichlorophenyl)-2-phenylacetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(3,5-dichlorophenyl)-2-phenyl-acetamide Formula: C19H13Cl2N5OS MolecularWeight: 430.31042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC(=CC(=C2)Cl)Cl)SC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC(=CC(=C2)Cl)Cl)SC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C19H13Cl2N5OS/c20-13-6-14(21)8-15(7-13)25-18(27)16(11-4-2-1-3-5-11)28-19-24-10-12(9-22)17(23)26-19/h1-8,10,16H,(H,25,27)(H2,23,24,26)