(4R,5S)-N-(4-bromophenyl)-3-oxidanylidene-4,5-diphenyl-pyrazolidine-1-carboxamide

Systemtic Name: (4R,5S)-N-(4-bromophenyl)-3-oxidanylidene-4,5-diphenyl-pyrazolidine-1-carboxamide Openeye Name: (4R,5S)-N-(4-bromophenyl)-3-oxo-4,5-diphenyl-pyrazolidine-1-carboxamide CAS Name: (4R,5S)-N-(4-bromophenyl)-3-oxo-4,5-diphenyl-1-pyrazolidinecarboxamide IUPAC Name: (4R,5S)-N-(4-bromophenyl)-3-oxo-4,5-diphenylpyrazolidine-1-carboxamide Traditional Name: (4R,5S)-N-(4-bromophenyl)-3-keto-4,5-diphenyl-pyrazolidine-1-carboxamide Formula: C22H18BrN3O2 MolecularWeight: 436.30122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(N(NC2=O)C(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2[C@H](N(NC2=O)C(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H18BrN3O2/c23-17-11-13-18(14-12-17)24-22(28)26-20(16-9-5-2-6-10-16)19(21(27)25-26)15-7-3-1-4-8-15/h1-14,19-20H,(H,24,28)(H,25,27)/t19-,20-/m1/s1