5-bromanyl-2-(2-methylpropoxy)-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-(2-methylpropoxy)-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-isobutoxy-N-[(2-isopropylphenyl)carbamothioyl]benzamide CAS Name: 5-bromo-2-(2-methylpropoxy)-N-[(2-propan-2-ylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-(2-methylpropoxy)-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-isobutoxy-N-(o-cumenylthiocarbamoyl)benzamide Formula: C21H25BrN2O2S MolecularWeight: 449.4044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2C(C)C

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2C(C)C

InChI

InChI=1S/C21H25BrN2O2S/c1-13(2)12-26-19-10-9-15(22)11-17(19)20(25)24-21(27)23-18-8-6-5-7-16(18)14(3)4/h5-11,13-14H,12H2,1-4H3,(H2,23,24,25,27)