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

Systemtic Name: N-[[4-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]phenyl]carbamothioyl]propanamide Openeye Name: N-[[4-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]phenyl]carbamothioyl]propanamide CAS Name: N-[[4-[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[4-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]phenyl]carbamothioyl]propanamide Traditional Name: N-[[4-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]phenyl]thiocarbamoyl]propionamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O3S/c1-4-17(25)24-20(28)23-15-7-5-14(6-8-15)22-18(26)11-27-16-9-12(2)19(21)13(3)10-16/h5-10H,4,11H2,1-3H3,(H,22,26)(H2,23,24,25,28)