5-(4-bromophenyl)-N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[[3-chloro-2-(1-piperidyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[[3-chloro-2-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[(3-chloro-2-piperidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[(3-chloro-2-piperidino-phenyl)thiocarbamoyl]-2-furamide Formula: C23H21BrClN3O2S MolecularWeight: 518.85374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H21BrClN3O2S/c24-16-9-7-15(8-10-16)19-11-12-20(30-19)22(29)27-23(31)26-18-6-4-5-17(25)21(18)28-13-2-1-3-14-28/h4-12H,1-3,13-14H2,(H2,26,27,29,31)