2-butoxy-N-[[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 2-butoxy-N-[[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 2-butoxy-N-[[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 2-butoxy-N-[[[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-butoxy-N-[[[2-(4-chloro-3-methylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 2-butoxy-N-[[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)COC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)COC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C21H24ClN3O4S/c1-3-4-11-28-18-8-6-5-7-16(18)20(27)23-21(30)25-24-19(26)13-29-15-9-10-17(22)14(2)12-15/h5-10,12H,3-4,11,13H2,1-2H3,(H,24,26)(H2,23,25,27,30)