2-(4-chlorophenyl)-N-[(3-morpholin-4-ylcarbonylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[(3-morpholin-4-ylcarbonylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[[3-(morpholine-4-carbonyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[[3-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[[3-(morpholine-4-carbonyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[[3-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]acetamide Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCCN1C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O3S/c21-16-6-4-14(5-7-16)12-18(25)23-20(28)22-17-3-1-2-15(13-17)19(26)24-8-10-27-11-9-24/h1-7,13H,8-12H2,(H2,22,23,25,28)