3-bromanyl-N-[(4-methylphenyl)methylcarbamothioyl]-4-(2-methylpropoxy)benzamide

Systemtic Name: 3-bromanyl-N-[(4-methylphenyl)methylcarbamothioyl]-4-(2-methylpropoxy)benzamide Openeye Name: 3-bromo-4-isobutoxy-N-(p-tolylmethylcarbamothioyl)benzamide CAS Name: 3-bromo-N-[[(4-methylphenyl)methylamino]-sulfanylidenemethyl]-4-(2-methylpropoxy)benzamide IUPAC Name: 3-bromo-N-[(4-methylphenyl)methylcarbamothioyl]-4-(2-methylpropoxy)benzamide Traditional Name: 3-bromo-4-isobutoxy-N-[(4-methylbenzyl)thiocarbamoyl]benzamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O2S/c1-13(2)12-25-18-9-8-16(10-17(18)21)19(24)23-20(26)22-11-15-6-4-14(3)5-7-15/h4-10,13H,11-12H2,1-3H3,(H2,22,23,24,26)