N-(5-bromanyl-2-morpholin-4-yl-phenyl)-4-(1,3-dithian-2-yl)benzamide

Systemtic Name: N-(5-bromanyl-2-morpholin-4-yl-phenyl)-4-(1,3-dithian-2-yl)benzamide Openeye Name: N-(5-bromo-2-morpholino-phenyl)-4-(1,3-dithian-2-yl)benzamide CAS Name: N-[5-bromo-2-(4-morpholinyl)phenyl]-4-(1,3-dithian-2-yl)benzamide IUPAC Name: N-(5-bromo-2-morpholin-4-ylphenyl)-4-(1,3-dithian-2-yl)benzamide Traditional Name: N-(5-bromo-2-morpholino-phenyl)-4-(1,3-dithian-2-yl)benzamide Formula: C21H23BrN2O2S2 MolecularWeight: 479.45352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)Br)N4CCOCC4

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)Br)N4CCOCC4

InChI

InChI=1S/C21H23BrN2O2S2/c22-17-6-7-19(24-8-10-26-11-9-24)18(14-17)23-20(25)15-2-4-16(5-3-15)21-27-12-1-13-28-21/h2-7,14,21H,1,8-13H2,(H,23,25)