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

Systemtic Name: 3-butoxy-N-[[2-(2,3-dimethylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[[2-(2,3-dimethylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[[2-(2,3-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[[2-(2,3-dimethylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[[2-(2,3-dimethylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC(=C2C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC(=C2C)C

InChI

InChI=1S/C22H27N3O4S/c1-4-5-12-28-18-10-7-9-17(13-18)21(27)23-22(30)25-24-20(26)14-29-19-11-6-8-15(2)16(19)3/h6-11,13H,4-5,12,14H2,1-3H3,(H,24,26)(H2,23,25,27,30)