2-[2,4-bis(bromanyl)-6-methyl-phenoxy]-N-[(2-phenylethanoylamino)carbamothioyl]ethanamide

Systemtic Name: 2-[2,4-bis(bromanyl)-6-methyl-phenoxy]-N-[(2-phenylethanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(2,4-dibromo-6-methyl-phenoxy)-N-[[(2-phenylacetyl)amino]carbamothioyl]acetamide CAS Name: 2-(2,4-dibromo-6-methylphenoxy)-N-[[(1-oxo-2-phenylethyl)hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2,4-dibromo-6-methylphenoxy)-N-[[(2-phenylacetyl)amino]carbamothioyl]acetamide Traditional Name: 2-(2,4-dibromo-6-methyl-phenoxy)-N-[[(2-phenylacetyl)amino]thiocarbamoyl]acetamide Formula: C18H17Br2N3O3S MolecularWeight: 515.21888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC(=S)NNC(=O)CC2=CC=CC=C2)Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC(=S)NNC(=O)CC2=CC=CC=C2)Br)Br

InChI

InChI=1S/C18H17Br2N3O3S/c1-11-7-13(19)9-14(20)17(11)26-10-16(25)21-18(27)23-22-15(24)8-12-5-3-2-4-6-12/h2-7,9H,8,10H2,1H3,(H,22,24)(H2,21,23,25,27)