N-(6-azanyl-4-oxidanylidene-2-propylsulfanyl-1H-pyrimidin-5-yl)-4-ethoxy-benzamide

Systemtic Name: N-(6-azanyl-4-oxidanylidene-2-propylsulfanyl-1H-pyrimidin-5-yl)-4-ethoxy-benzamide Openeye Name: N-(6-amino-4-oxo-2-propylsulfanyl-1H-pyrimidin-5-yl)-4-ethoxy-benzamide CAS Name: N-[6-amino-4-oxo-2-(propylthio)-1H-pyrimidin-5-yl]-4-ethoxybenzamide IUPAC Name: N-(6-amino-4-oxo-2-propylsulfanyl-1H-pyrimidin-5-yl)-4-ethoxybenzamide Traditional Name: N-[6-amino-4-keto-2-(propylthio)-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Formula: C16H20N4O3S MolecularWeight: 348.42

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C16H20N4O3S/c1-3-9-24-16-19-13(17)12(15(22)20-16)18-14(21)10-5-7-11(8-6-10)23-4-2/h5-8H,3-4,9H2,1-2H3,(H,18,21)(H3,17,19,20,22)