5-bromanyl-N-(2-nitro-5-propylsulfanyl-phenyl)pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-(2-nitro-5-propylsulfanyl-phenyl)pyridine-3-carboxamide Openeye Name: 5-bromo-N-(2-nitro-5-propylsulfanyl-phenyl)pyridine-3-carboxamide CAS Name: 5-bromo-N-[2-nitro-5-(propylthio)phenyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-(2-nitro-5-propylsulfanylphenyl)pyridine-3-carboxamide Traditional Name: 5-bromo-N-[2-nitro-5-(propylthio)phenyl]nicotinamide Formula: C15H14BrN3O3S MolecularWeight: 396.25896

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C15H14BrN3O3S/c1-2-5-23-12-3-4-14(19(21)22)13(7-12)18-15(20)10-6-11(16)9-17-8-10/h3-4,6-9H,2,5H2,1H3,(H,18,20)