N-(2-chloranyl-4-nitro-phenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[(6-keto-1H-pyrimidin-2-yl)thio]acetamide Formula: C12H9ClN4O4S MolecularWeight: 340.74226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9ClN4O4S/c13-8-5-7(17(20)21)1-2-9(8)15-11(19)6-22-12-14-4-3-10(18)16-12/h1-5H,6H2,(H,15,19)(H,14,16,18)