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

Systemtic Name: N-[(3-chloranyl-2-morpholin-4-yl-phenyl)carbamothioyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(3-chloro-2-morpholino-phenyl)carbamothioyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[[3-chloro-2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(3-chloro-2-morpholin-4-ylphenyl)carbamothioyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(3-chloro-2-morpholino-phenyl)thiocarbamoyl]-3,4,5-trimethoxy-benzamide Formula: C21H24ClN3O5S MolecularWeight: 465.95036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)N3CCOCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)N3CCOCC3

InChI

InChI=1S/C21H24ClN3O5S/c1-27-16-11-13(12-17(28-2)19(16)29-3)20(26)24-21(31)23-15-6-4-5-14(22)18(15)25-7-9-30-10-8-25/h4-6,11-12H,7-10H2,1-3H3,(H2,23,24,26,31)