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

Systemtic Name: 5-chloranyl-N-(2-chloranyl-4-nitro-phenyl)-2-ethylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(2-chloro-4-nitro-phenyl)-2-ethylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(2-chloro-4-nitrophenyl)-2-(ethylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(2-chloro-4-nitrophenyl)-2-ethylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(2-chloro-4-nitro-phenyl)-2-(ethylthio)pyrimidine-4-carboxamide Formula: C13H10Cl2N4O3S MolecularWeight: 373.2145

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C13H10Cl2N4O3S/c1-2-23-13-16-6-9(15)11(18-13)12(20)17-10-4-3-7(19(21)22)5-8(10)14/h3-6H,2H2,1H3,(H,17,20)