1-(4-methyl-3-nitro-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-methyl-3-nitro-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(4-methyl-3-nitrophenyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(4-methyl-3-nitrophenyl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(4-methyl-3-nitro-phenyl)-2-(2-pyrimidylthio)ethanone Formula: C13H11N3O3S MolecularWeight: 289.30974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSC2=NC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSC2=NC=CC=N2)[N+](=O)[O-]

InChI

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