N-[[4-[2-(2-chloranylphenoxy)propanoylamino]phenyl]carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[[4-[2-(2-chloranylphenoxy)propanoylamino]phenyl]carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[[4-[2-(2-chlorophenoxy)propanoylamino]phenyl]carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[4-[[2-(2-chlorophenoxy)-1-oxopropyl]amino]anilino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[[4-[2-(2-chlorophenoxy)propanoylamino]phenyl]carbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[[4-[2-(2-chlorophenoxy)propanoylamino]phenyl]thiocarbamoyl]-2,2-dimethyl-propionamide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C(C)(C)C)OC2=CC=CC=C2Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C(C)(C)C)OC2=CC=CC=C2Cl

InChI

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