2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-2-phenyl-acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-2-phenylacetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-2-phenyl-acetamide Formula: C13H11N5OS MolecularWeight: 285.32434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N)SC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)N)SC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C13H11N5OS/c14-6-9-7-17-13(18-11(9)15)20-10(12(16)19)8-4-2-1-3-5-8/h1-5,7,10H,(H2,16,19)(H2,15,17,18)