2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(4-tert-butyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(4-tert-butyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(4-tert-butylthiazol-2-yl)acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-(4-tert-butyl-2-thiazolyl)acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(4-tert-butylthiazol-2-yl)acetamide Formula: C14H16N6OS2 MolecularWeight: 348.44644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C14H16N6OS2/c1-14(2,3)9-6-22-13(18-9)19-10(21)7-23-12-17-5-8(4-15)11(16)20-12/h5-6H,7H2,1-3H3,(H2,16,17,20)(H,18,19,21)