3-bromanyl-N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]benzamide CAS Name: 3-bromo-N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]benzamide Formula: C18H17BrClN3OS MolecularWeight: 438.76908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C18H17BrClN3OS/c19-13-6-3-5-12(11-13)17(24)22-18(25)21-15-8-4-7-14(20)16(15)23-9-1-2-10-23/h3-8,11H,1-2,9-10H2,(H2,21,22,24,25)