2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(cyclohexylcarbamoyl)propanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(cyclohexylcarbamoyl)propanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(cyclohexylcarbamoyl)propanamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-[(cyclohexylamino)-oxomethyl]propanamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(cyclohexylcarbamoyl)propanamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(cyclohexylcarbamoyl)propionamide Formula: C15H20N6O2S MolecularWeight: 348.4233

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)SC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC(C(=O)NC(=O)NC1CCCCC1)SC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C15H20N6O2S/c1-9(24-15-18-8-10(7-16)12(17)20-15)13(22)21-14(23)19-11-5-3-2-4-6-11/h8-9,11H,2-6H2,1H3,(H2,17,18,20)(H2,19,21,22,23)