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

Systemtic Name: 5-chloranyl-N-(4-ethoxy-2-nitro-phenyl)-2-propylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(4-ethoxy-2-nitro-phenyl)-2-propylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(4-ethoxy-2-nitrophenyl)-2-propylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(4-ethoxy-2-nitrophenyl)-2-propylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(4-ethoxy-2-nitro-phenyl)-2-propylsulfonyl-pyrimidine-4-carboxamide Formula: C16H17ClN4O6S MolecularWeight: 428.84738

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C=C(C=C2)OCC)[N+](=O)[O-])Cl

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C=C(C=C2)OCC)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H17ClN4O6S/c1-3-7-28(25,26)16-18-9-11(17)14(20-16)15(22)19-12-6-5-10(27-4-2)8-13(12)21(23)24/h5-6,8-9H,3-4,7H2,1-2H3,(H,19,22)