4-bromanyl-1,5-dimethyl-N-(3-nitro-5-pyridin-2-ylsulfanyl-phenyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1,5-dimethyl-N-(3-nitro-5-pyridin-2-ylsulfanyl-phenyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-1,5-dimethyl-N-[3-nitro-5-(2-pyridylsulfanyl)phenyl]pyrazole-3-carboxamide CAS Name: 4-bromo-1,5-dimethyl-N-[3-nitro-5-(2-pyridinylthio)phenyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1,5-dimethyl-N-(3-nitro-5-pyridin-2-ylsulfanylphenyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-1,5-dimethyl-N-[3-nitro-5-(2-pyridylthio)phenyl]pyrazole-3-carboxamide Formula: C17H14BrN5O3S MolecularWeight: 448.29376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NC2=CC(=CC(=C2)SC3=CC=CC=N3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NC2=CC(=CC(=C2)SC3=CC=CC=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C17H14BrN5O3S/c1-10-15(18)16(21-22(10)2)17(24)20-11-7-12(23(25)26)9-13(8-11)27-14-5-3-4-6-19-14/h3-9H,1-2H3,(H,20,24)