5-chloranyl-N-(4-ethoxy-2-nitro-phenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(4-ethoxy-2-nitro-phenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(4-ethoxy-2-nitro-phenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(4-ethoxy-2-nitrophenyl)-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(4-ethoxy-2-nitrophenyl)-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(4-ethoxy-2-nitro-phenyl)-2-mesyl-pyrimidine-4-carboxamide Formula: C14H13ClN4O6S MolecularWeight: 400.79422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C14H13ClN4O6S/c1-3-25-8-4-5-10(11(6-8)19(21)22)17-13(20)12-9(15)7-16-14(18-12)26(2,23)24/h4-7H,3H2,1-2H3,(H,17,20)