N-[(3-chloranyl-2-morpholin-4-yl-phenyl)carbamothioyl]-2,4-dimethoxy-benzamide

Systemtic Name: N-[(3-chloranyl-2-morpholin-4-yl-phenyl)carbamothioyl]-2,4-dimethoxy-benzamide Openeye Name: N-[(3-chloro-2-morpholino-phenyl)carbamothioyl]-2,4-dimethoxy-benzamide CAS Name: N-[[3-chloro-2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-2,4-dimethoxybenzamide IUPAC Name: N-[(3-chloro-2-morpholin-4-ylphenyl)carbamothioyl]-2,4-dimethoxybenzamide Traditional Name: N-[(3-chloro-2-morpholino-phenyl)thiocarbamoyl]-2,4-dimethoxy-benzamide Formula: C20H22ClN3O4S MolecularWeight: 435.92438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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