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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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