N-[[4-[2-(4-bromanylphenoxy)ethanoylamino]phenyl]carbamothioyl]propanamide

Systemtic Name: N-[[4-[2-(4-bromanylphenoxy)ethanoylamino]phenyl]carbamothioyl]propanamide Openeye Name: N-[[4-[[2-(4-bromophenoxy)acetyl]amino]phenyl]carbamothioyl]propanamide CAS Name: N-[[4-[[2-(4-bromophenoxy)-1-oxoethyl]amino]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[4-[[2-(4-bromophenoxy)acetyl]amino]phenyl]carbamothioyl]propanamide Traditional Name: N-[[4-[[2-(4-bromophenoxy)acetyl]amino]phenyl]thiocarbamoyl]propionamide Formula: C18H18BrN3O3S MolecularWeight: 436.32282

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrN3O3S/c1-2-16(23)22-18(26)21-14-7-5-13(6-8-14)20-17(24)11-25-15-9-3-12(19)4-10-15/h3-10H,2,11H2,1H3,(H,20,24)(H2,21,22,23,26)