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

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

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