N-[3-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylcarbamothioylamino]phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylcarbamothioylamino]phenyl]-2-methyl-propanamide Openeye Name: N-[3-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]carbamothioylamino]phenyl]-2-methyl-propanamide CAS Name: N-[3-[[[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-methylpropanamide IUPAC Name: N-[3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]carbamothioylamino]phenyl]-2-methylpropanamide Traditional Name: N-[3-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]thiocarbamoylamino]phenyl]-2-methyl-propionamide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)C

InChI

InChI=1S/C21H24ClN3O3S/c1-12(2)20(27)23-15-6-5-7-16(10-15)24-21(29)25-18(26)11-28-17-8-13(3)19(22)14(4)9-17/h5-10,12H,11H2,1-4H3,(H,23,27)(H2,24,25,26,29)