2-(2,5-dimethylphenoxy)-N-[[2-(2-methylphenoxy)ethanoylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(2,5-dimethylphenoxy)-N-[[2-(2-methylphenoxy)ethanoylamino]carbamothioyl]ethanamide Openeye Name: 2-(2,5-dimethylphenoxy)-N-[[[2-(2-methylphenoxy)acetyl]amino]carbamothioyl]acetamide CAS Name: 2-(2,5-dimethylphenoxy)-N-[[[2-(2-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2,5-dimethylphenoxy)-N-[[[2-(2-methylphenoxy)acetyl]amino]carbamothioyl]acetamide Traditional Name: 2-(2,5-dimethylphenoxy)-N-[[[2-(2-methylphenoxy)acetyl]amino]thiocarbamoyl]acetamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)NC(=S)NNC(=O)COC2=CC=CC=C2C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)NC(=S)NNC(=O)COC2=CC=CC=C2C

InChI

InChI=1S/C20H23N3O4S/c1-13-8-9-15(3)17(10-13)27-11-18(24)21-20(28)23-22-19(25)12-26-16-7-5-4-6-14(16)2/h4-10H,11-12H2,1-3H3,(H,22,25)(H2,21,23,24,28)