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

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-octan-2-yl-ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(1-methylheptyl)acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-octan-2-ylacetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-octan-2-ylacetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(1-methylheptyl)acetamide Formula: C15H23N5OS MolecularWeight: 321.44102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)CSC1=NC=C(C(=N1)N)C#N

Isomeric SMILES

CCCCCCC(C)NC(=O)CSC1=NC=C(C(=N1)N)C#N

InChI

InChI=1S/C15H23N5OS/c1-3-4-5-6-7-11(2)19-13(21)10-22-15-18-9-12(8-16)14(17)20-15/h9,11H,3-7,10H2,1-2H3,(H,19,21)(H2,17,18,20)