N-[(5-chloranyl-2-morpholin-4-yl-phenyl)carbamothioyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[(5-chloranyl-2-morpholin-4-yl-phenyl)carbamothioyl]-2,6-dimethoxy-benzamide Openeye Name: N-[(5-chloro-2-morpholino-phenyl)carbamothioyl]-2,6-dimethoxy-benzamide CAS Name: N-[[5-chloro-2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-2,6-dimethoxybenzamide IUPAC Name: N-[(5-chloro-2-morpholin-4-ylphenyl)carbamothioyl]-2,6-dimethoxybenzamide Traditional Name: N-[(5-chloro-2-morpholino-phenyl)thiocarbamoyl]-2,6-dimethoxy-benzamide Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=C(C=CC(=C2)Cl)N3CCOCC3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=C(C=CC(=C2)Cl)N3CCOCC3

InChI

InChI=1S/C20H22ClN3O4S/c1-26-16-4-3-5-17(27-2)18(16)19(25)23-20(29)22-14-12-13(21)6-7-15(14)24-8-10-28-11-9-24/h3-7,12H,8-11H2,1-2H3,(H2,22,23,25,29)