4-bromanyl-2-methyl-N-(2-phenylsulfanylphenyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-methyl-N-(2-phenylsulfanylphenyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-2-methyl-N-(2-phenylsulfanylphenyl)pyrazole-3-carboxamide CAS Name: 4-bromo-2-methyl-N-[2-(phenylthio)phenyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-methyl-N-(2-phenylsulfanylphenyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-2-methyl-N-[2-(phenylthio)phenyl]pyrazole-3-carboxamide Formula: C17H14BrN3OS MolecularWeight: 388.28156

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C=N1)Br)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3

InChI

InChI=1S/C17H14BrN3OS/c1-21-16(13(18)11-19-21)17(22)20-14-9-5-6-10-15(14)23-12-7-3-2-4-8-12/h2-11H,1H3,(H,20,22)