2-(4-bromanyl-2-methyl-phenoxy)-N-[[(3,4,5-trimethoxyphenyl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenoxy)-N-[[(3,4,5-trimethoxyphenyl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenoxy)-N-[[(3,4,5-trimethoxybenzoyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-bromo-2-methylphenoxy)-N-[[[oxo-(3,4,5-trimethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-2-methylphenoxy)-N-[[(3,4,5-trimethoxybenzoyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-methyl-phenoxy)-N-[[(3,4,5-trimethoxybenzoyl)amino]thiocarbamoyl]acetamide Formula: C20H22BrN3O6S MolecularWeight: 512.37418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrN3O6S/c1-11-7-13(21)5-6-14(11)30-10-17(25)22-20(31)24-23-19(26)12-8-15(27-2)18(29-4)16(9-12)28-3/h5-9H,10H2,1-4H3,(H,23,26)(H2,22,24,25,31)