5-oxidanylidene-3-phenyl-4-[[2,4,6-tris(bromanyl)phenyl]hydrazinylidene]pyrazole-1-carbothioamide

Systemtic Name: 5-oxidanylidene-3-phenyl-4-[[2,4,6-tris(bromanyl)phenyl]hydrazinylidene]pyrazole-1-carbothioamide Openeye Name: 5-oxo-3-phenyl-4-[(2,4,6-tribromophenyl)hydrazono]pyrazole-1-carbothioamide CAS Name: 5-oxo-3-phenyl-4-[(2,4,6-tribromophenyl)hydrazinylidene]-1-pyrazolecarbothioamide IUPAC Name: 5-oxo-3-phenyl-4-[(2,4,6-tribromophenyl)hydrazinylidene]pyrazole-1-carbothioamide Traditional Name: 5-keto-3-phenyl-4-[(2,4,6-tribromophenyl)hydrazono]-2-pyrazoline-1-carbothioamide Formula: C16H10Br3N5OS MolecularWeight: 560.0605

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=C(C=C(C=C3Br)Br)Br)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=C(C=C(C=C3Br)Br)Br)C(=S)N

InChI

InChI=1S/C16H10Br3N5OS/c17-9-6-10(18)13(11(19)7-9)21-22-14-12(8-4-2-1-3-5-8)23-24(15(14)25)16(20)26/h1-7,21H,(H2,20,26)