N-[(2-bromanyl-4-nitro-phenyl)carbamothioyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[(2-bromanyl-4-nitro-phenyl)carbamothioyl]-2,2-diphenyl-ethanamide Openeye Name: N-[(2-bromo-4-nitro-phenyl)carbamothioyl]-2,2-diphenyl-acetamide CAS Name: N-[(2-bromo-4-nitroanilino)-sulfanylidenemethyl]-2,2-diphenylacetamide IUPAC Name: N-[(2-bromo-4-nitrophenyl)carbamothioyl]-2,2-diphenylacetamide Traditional Name: N-[(2-bromo-4-nitro-phenyl)thiocarbamoyl]-2,2-diphenyl-acetamide Formula: C21H16BrN3O3S MolecularWeight: 470.33904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC(=S)NC3=C(C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC(=S)NC3=C(C=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C21H16BrN3O3S/c22-17-13-16(25(27)28)11-12-18(17)23-21(29)24-20(26)19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,19H,(H2,23,24,26,29)