3,5-bis(bromanyl)-N-[(5-chloranyl-2-morpholin-4-yl-phenyl)carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 3,5-bis(bromanyl)-N-[(5-chloranyl-2-morpholin-4-yl-phenyl)carbamothioyl]-2-methoxy-benzamide Openeye Name: 3,5-dibromo-N-[(5-chloro-2-morpholino-phenyl)carbamothioyl]-2-methoxy-benzamide CAS Name: 3,5-dibromo-N-[[5-chloro-2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 3,5-dibromo-N-[(5-chloro-2-morpholin-4-ylphenyl)carbamothioyl]-2-methoxybenzamide Traditional Name: 3,5-dibromo-N-[(5-chloro-2-morpholino-phenyl)thiocarbamoyl]-2-methoxy-benzamide Formula: C19H18Br2ClN3O3S MolecularWeight: 563.69052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)NC(=S)NC2=C(C=CC(=C2)Cl)N3CCOCC3)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)NC(=S)NC2=C(C=CC(=C2)Cl)N3CCOCC3)Br)Br

InChI

InChI=1S/C19H18Br2ClN3O3S/c1-27-17-13(8-11(20)9-14(17)21)18(26)24-19(29)23-15-10-12(22)2-3-16(15)25-4-6-28-7-5-25/h2-3,8-10H,4-7H2,1H3,(H2,23,24,26,29)