N-[[2-(2,6-dimethylphenoxy)ethanoylamino]carbamothioyl]-2-(2-ethoxyethoxy)benzamide

Systemtic Name: N-[[2-(2,6-dimethylphenoxy)ethanoylamino]carbamothioyl]-2-(2-ethoxyethoxy)benzamide Openeye Name: N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamothioyl]-2-(2-ethoxyethoxy)benzamide CAS Name: N-[[[2-(2,6-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(2-ethoxyethoxy)benzamide IUPAC Name: N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamothioyl]-2-(2-ethoxyethoxy)benzamide Traditional Name: N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]thiocarbamoyl]-2-(2-ethoxyethoxy)benzamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)COC2=C(C=CC=C2C)C

Isomeric SMILES

CCOCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)COC2=C(C=CC=C2C)C

InChI

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