N-[4-methyl-6-(4-nitrophenyl)sulfanyl-pyrimidin-2-yl]ethanamide

Systemtic Name: N-[4-methyl-6-(4-nitrophenyl)sulfanyl-pyrimidin-2-yl]ethanamide Openeye Name: N-[4-methyl-6-(4-nitrophenyl)sulfanyl-pyrimidin-2-yl]acetamide CAS Name: N-[4-methyl-6-[(4-nitrophenyl)thio]-2-pyrimidinyl]acetamide IUPAC Name: N-[4-methyl-6-(4-nitrophenyl)sulfanylpyrimidin-2-yl]acetamide Traditional Name: N-[4-methyl-6-[(4-nitrophenyl)thio]pyrimidin-2-yl]acetamide Formula: C13H12N4O3S MolecularWeight: 304.32438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)C)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)C)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O3S/c1-8-7-12(16-13(14-8)15-9(2)18)21-11-5-3-10(4-6-11)17(19)20/h3-7H,1-2H3,(H,14,15,16,18)