5-bromanyl-2-(3-methylbutoxy)-N-(1-phenylpropylcarbamothioyl)benzamide

Systemtic Name: 5-bromanyl-2-(3-methylbutoxy)-N-(1-phenylpropylcarbamothioyl)benzamide Openeye Name: 5-bromo-2-isopentyloxy-N-(1-phenylpropylcarbamothioyl)benzamide CAS Name: 5-bromo-2-(3-methylbutoxy)-N-[(1-phenylpropylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-(3-methylbutoxy)-N-(1-phenylpropylcarbamothioyl)benzamide Traditional Name: 5-bromo-2-isoamoxy-N-(1-phenylpropylthiocarbamoyl)benzamide Formula: C22H27BrN2O2S MolecularWeight: 463.43098

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC(C)C

Isomeric SMILES

CCC(C1=CC=CC=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC(C)C

InChI

InChI=1S/C22H27BrN2O2S/c1-4-19(16-8-6-5-7-9-16)24-22(28)25-21(26)18-14-17(23)10-11-20(18)27-13-12-15(2)3/h5-11,14-15,19H,4,12-13H2,1-3H3,(H2,24,25,26,28)