N-[[2-(3,5-dimethylphenoxy)ethanoylamino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide

Systemtic Name: N-[[2-(3,5-dimethylphenoxy)ethanoylamino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Openeye Name: N-[[[2-(3,5-dimethylphenoxy)acetyl]amino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide CAS Name: N-[[[2-(3,5-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-(2-ethoxyethoxy)benzamide IUPAC Name: N-[[[2-(3,5-dimethylphenoxy)acetyl]amino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Traditional Name: N-[[[2-(3,5-dimethylphenoxy)acetyl]amino]thiocarbamoyl]-3-(2-ethoxyethoxy)benzamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C22H27N3O5S/c1-4-28-8-9-29-18-7-5-6-17(13-18)21(27)23-22(31)25-24-20(26)14-30-19-11-15(2)10-16(3)12-19/h5-7,10-13H,4,8-9,14H2,1-3H3,(H,24,26)(H2,23,25,27,31)