4-chloranyl-N-(4-methoxy-2-nitro-phenyl)-2-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: 4-chloranyl-N-(4-methoxy-2-nitro-phenyl)-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: 4-chloro-N-(4-methoxy-2-nitro-phenyl)-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: 4-chloro-N-(4-methoxy-2-nitrophenyl)-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: 4-chloro-N-(4-methoxy-2-nitrophenyl)-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: 4-chloro-N-(4-methoxy-2-nitro-phenyl)-2-(methylthio)pyrimidine-5-carboxamide Formula: C13H11ClN4O4S MolecularWeight: 354.76884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=CN=C(N=C2Cl)SC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=CN=C(N=C2Cl)SC)[N+](=O)[O-]

InChI

InChI=1S/C13H11ClN4O4S/c1-22-7-3-4-9(10(5-7)18(20)21)16-12(19)8-6-15-13(23-2)17-11(8)14/h3-6H,1-2H3,(H,16,19)