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

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-(1-phenylethylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-(1-phenylethylcarbamothioyl)benzamide CAS Name: 3-bromo-4-(3-methylbutoxy)-N-[(1-phenylethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(3-methylbutoxy)-N-(1-phenylethylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-isoamoxy-N-(1-phenylethylthiocarbamoyl)benzamide Formula: C21H25BrN2O2S MolecularWeight: 449.4044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC(C)C2=CC=CC=C2)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC(C)C2=CC=CC=C2)Br

InChI

InChI=1S/C21H25BrN2O2S/c1-14(2)11-12-26-19-10-9-17(13-18(19)22)20(25)24-21(27)23-15(3)16-7-5-4-6-8-16/h4-10,13-15H,11-12H2,1-3H3,(H2,23,24,25,27)