2-(4-methylpyrimidin-2-yl)sulfanyl-1-(4-nitrophenyl)ethanone

Systemtic Name: 2-(4-methylpyrimidin-2-yl)sulfanyl-1-(4-nitrophenyl)ethanone Openeye Name: 2-(4-methylpyrimidin-2-yl)sulfanyl-1-(4-nitrophenyl)ethanone CAS Name: 2-[(4-methyl-2-pyrimidinyl)thio]-1-(4-nitrophenyl)ethanone IUPAC Name: 2-(4-methylpyrimidin-2-yl)sulfanyl-1-(4-nitrophenyl)ethanone Traditional Name: 2-[(4-methylpyrimidin-2-yl)thio]-1-(4-nitrophenyl)ethanone Formula: C13H11N3O3S MolecularWeight: 289.30974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=NC=C1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O3S/c1-9-6-7-14-13(15-9)20-8-12(17)10-2-4-11(5-3-10)16(18)19/h2-7H,8H2,1H3