2-(4-bromanylphenoxy)-N-[(3-chloranyl-4-pyrrolidin-1-yl-phenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[(3-chloranyl-4-pyrrolidin-1-yl-phenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[(3-chloro-4-pyrrolidin-1-yl-phenyl)carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[[3-chloro-4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[(3-chloro-4-pyrrolidino-phenyl)thiocarbamoyl]acetamide Formula: C19H19BrClN3O2S MolecularWeight: 468.79506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)NC(=S)NC(=O)COC3=CC=C(C=C3)Br)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)NC(=S)NC(=O)COC3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C19H19BrClN3O2S/c20-13-3-6-15(7-4-13)26-12-18(25)23-19(27)22-14-5-8-17(16(21)11-14)24-9-1-2-10-24/h3-8,11H,1-2,9-10,12H2,(H2,22,23,25,27)