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

Systemtic Name: N-[[4-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylcarbamothioylamino]phenyl]carbamothioyl]propanamide Openeye Name: N-[[4-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]carbamothioylamino]phenyl]carbamothioyl]propanamide CAS Name: N-[[4-[[[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[4-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]carbamothioylamino]phenyl]carbamothioyl]propanamide Traditional Name: N-[[4-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]thiocarbamoylamino]phenyl]thiocarbamoyl]propionamide Formula: C21H23ClN4O3S2 MolecularWeight: 479.01532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC(=C(C(=C2)C)Cl)C

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC(=C(C(=C2)C)Cl)C

InChI

InChI=1S/C21H23ClN4O3S2/c1-4-17(27)25-20(30)23-14-5-7-15(8-6-14)24-21(31)26-18(28)11-29-16-9-12(2)19(22)13(3)10-16/h5-10H,4,11H2,1-3H3,(H2,23,25,27,30)(H2,24,26,28,31)