N-(4-chloranyl-3-nitro-phenyl)-2-phenyl-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-phenyl-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-phenyl-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-phenyl-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-phenyl-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-phenyl-2-(2-pyrimidylthio)acetamide Formula: C18H13ClN4O3S MolecularWeight: 400.83882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])SC3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])SC3=NC=CC=N3

InChI

InChI=1S/C18H13ClN4O3S/c19-14-8-7-13(11-15(14)23(25)26)22-17(24)16(12-5-2-1-3-6-12)27-18-20-9-4-10-21-18/h1-11,16H,(H,22,24)