3-bromanyl-4-methyl-N-(1-phenylethylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-methyl-N-(1-phenylethylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-methyl-N-(1-phenylethylcarbamothioyl)benzamide CAS Name: 3-bromo-4-methyl-N-[(1-phenylethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-methyl-N-(1-phenylethylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-methyl-N-(1-phenylethylthiocarbamoyl)benzamide Formula: C17H17BrN2OS MolecularWeight: 377.29868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC(C)C2=CC=CC=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC(C)C2=CC=CC=C2)Br

InChI

InChI=1S/C17H17BrN2OS/c1-11-8-9-14(10-15(11)18)16(21)20-17(22)19-12(2)13-6-4-3-5-7-13/h3-10,12H,1-2H3,(H2,19,20,21,22)