3-(2-chlorophenyl)-N-[[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[[2-(5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]thiocarbamoyl]propionamide Formula: C22H26ClN3O3S MolecularWeight: 447.97814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C22H26ClN3O3S/c1-14(2)17-10-8-15(3)12-19(17)29-13-21(28)25-26-22(30)24-20(27)11-9-16-6-4-5-7-18(16)23/h4-8,10,12,14H,9,11,13H2,1-3H3,(H,25,28)(H2,24,26,27,30)