N-methyl-2-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanamide

Systemtic Name: N-methyl-2-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanamide Openeye Name: N-methyl-2-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetamide CAS Name: N-methyl-2-[2-[(3-nitrophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]acetamide IUPAC Name: N-methyl-2-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetamide Traditional Name: 2-[4-keto-2-[(3-nitrobenzyl)thio]-1H-pyrimidin-6-yl]-N-methyl-acetamide Formula: C14H14N4O4S MolecularWeight: 334.35036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC1=CC(=O)N=C(N1)SCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CNC(=O)CC1=CC(=O)N=C(N1)SCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O4S/c1-15-12(19)6-10-7-13(20)17-14(16-10)23-8-9-3-2-4-11(5-9)18(21)22/h2-5,7H,6,8H2,1H3,(H,15,19)(H,16,17,20)