5-chloranyl-2-ethylsulfanyl-N-(3-nitrophenyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-ethylsulfanyl-N-(3-nitrophenyl)pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-ethylsulfanyl-N-(3-nitrophenyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(ethylthio)-N-(3-nitrophenyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-ethylsulfanyl-N-(3-nitrophenyl)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(ethylthio)-N-(3-nitrophenyl)pyrimidine-4-carboxamide Formula: C13H11ClN4O3S MolecularWeight: 338.76944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN4O3S/c1-2-22-13-15-7-10(14)11(17-13)12(19)16-8-4-3-5-9(6-8)18(20)21/h3-7H,2H2,1H3,(H,16,19)