2-bromanyl-N-[(4-butan-2-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[(4-butan-2-ylphenyl)carbamothioyl]benzamide Openeye Name: 2-bromo-N-[(4-sec-butylphenyl)carbamothioyl]benzamide CAS Name: 2-bromo-N-[(4-butan-2-ylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[(4-butan-2-ylphenyl)carbamothioyl]benzamide Traditional Name: 2-bromo-N-[(4-sec-butylphenyl)thiocarbamoyl]benzamide Formula: C18H19BrN2OS MolecularWeight: 391.32526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C18H19BrN2OS/c1-3-12(2)13-8-10-14(11-9-13)20-18(23)21-17(22)15-6-4-5-7-16(15)19/h4-12H,3H2,1-2H3,(H2,20,21,22,23)