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

Systemtic Name: N-[6-azanyl-2-(2-methoxyethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Openeye Name: N-[6-amino-2-(2-methoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-ethoxy-benzamide CAS Name: N-[6-amino-2-(2-methoxyethylthio)-4-oxo-1H-pyrimidin-5-yl]-4-ethoxybenzamide IUPAC Name: N-[6-amino-2-(2-methoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-ethoxybenzamide Traditional Name: N-[6-amino-4-keto-2-(2-methoxyethylthio)-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCCOC)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCCOC)N

InChI

InChI=1S/C16H20N4O4S/c1-3-24-11-6-4-10(5-7-11)14(21)18-12-13(17)19-16(20-15(12)22)25-9-8-23-2/h4-7H,3,8-9H2,1-2H3,(H,18,21)(H3,17,19,20,22)