2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(2-butan-2-ylphenyl)ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(2-butan-2-ylphenyl)ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(2-sec-butylphenyl)acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-(2-butan-2-ylphenyl)acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(2-butan-2-ylphenyl)acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-(2-sec-butylphenyl)acetamide Formula: C16H20N4O2S MolecularWeight: 332.4206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)CSC2=NC(=O)C=C(N2)N

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)CSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C16H20N4O2S/c1-3-10(2)11-6-4-5-7-12(11)18-15(22)9-23-16-19-13(17)8-14(21)20-16/h4-8,10H,3,9H2,1-2H3,(H,18,22)(H3,17,19,20,21)