N-(2-methyl-3-nitro-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(2-methyl-3-nitro-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(2-methyl-3-nitro-phenyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(2-methyl-3-nitrophenyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(2-methyl-3-nitrophenyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(2-methyl-3-nitro-phenyl)-2-(2-pyrimidylthio)acetamide Formula: C13H12N4O3S MolecularWeight: 304.32438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4O3S/c1-9-10(4-2-5-11(9)17(19)20)16-12(18)8-21-13-14-6-3-7-15-13/h2-7H,8H2,1H3,(H,16,18)