4-bromanyl-N-[(2,6-diethylphenyl)carbamothioyl]benzamide

Systemtic Name: 4-bromanyl-N-[(2,6-diethylphenyl)carbamothioyl]benzamide Openeye Name: 4-bromo-N-[(2,6-diethylphenyl)carbamothioyl]benzamide CAS Name: 4-bromo-N-[(2,6-diethylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[(2,6-diethylphenyl)carbamothioyl]benzamide Traditional Name: 4-bromo-N-[(2,6-diethylphenyl)thiocarbamoyl]benzamide Formula: C18H19BrN2OS MolecularWeight: 391.32526

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H19BrN2OS/c1-3-12-6-5-7-13(4-2)16(12)20-18(23)21-17(22)14-8-10-15(19)11-9-14/h5-11H,3-4H2,1-2H3,(H2,20,21,22,23)