2-(4-bromanyl-3-methyl-phenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-3-methyl-phenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-3-methyl-phenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide CAS Name: 2-(4-bromo-3-methylphenoxy)-N-[[(1-oxo-3-phenylpropyl)hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-3-methylphenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-3-methyl-phenoxy)-N-[(hydrocinnamoylamino)thiocarbamoyl]acetamide Formula: C19H20BrN3O3S MolecularWeight: 450.3494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC(=S)NNC(=O)CCC2=CC=CC=C2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC(=S)NNC(=O)CCC2=CC=CC=C2)Br

InChI

InChI=1S/C19H20BrN3O3S/c1-13-11-15(8-9-16(13)20)26-12-18(25)21-19(27)23-22-17(24)10-7-14-5-3-2-4-6-14/h2-6,8-9,11H,7,10,12H2,1H3,(H,22,24)(H2,21,23,25,27)