2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide CAS Name: 2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide Traditional Name: 2-[(5-ethyl-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-N-(4-nitrophenyl)acetamide Formula: C15H16N4O4S MolecularWeight: 348.37694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H16N4O4S/c1-3-12-9(2)16-15(18-14(12)21)24-8-13(20)17-10-4-6-11(7-5-10)19(22)23/h4-7H,3,8H2,1-2H3,(H,17,20)(H,16,18,21)