3-(2-chlorophenyl)-5-methyl-N-(2-morpholin-4-ylethylcarbamothioyl)-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-N-(2-morpholin-4-ylethylcarbamothioyl)-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-5-methyl-N-(2-morpholinoethylcarbamothioyl)isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-5-methyl-N-[[2-(4-morpholinyl)ethylamino]-sulfanylidenemethyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-5-methyl-N-(2-morpholin-4-ylethylcarbamothioyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-5-methyl-N-(2-morpholinoethylthiocarbamoyl)isoxazole-4-carboxamide Formula: C18H21ClN4O3S MolecularWeight: 408.90234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NCCN3CCOCC3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NCCN3CCOCC3

InChI

InChI=1S/C18H21ClN4O3S/c1-12-15(16(22-26-12)13-4-2-3-5-14(13)19)17(24)21-18(27)20-6-7-23-8-10-25-11-9-23/h2-5H,6-11H2,1H3,(H2,20,21,24,27)