3-(2-chlorophenyl)-5-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-5-methyl-N-[(4-morpholinosulfonylphenyl)carbamothioyl]isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-5-methyl-N-[[4-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-5-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-5-methyl-N-[(4-morpholinosulfonylphenyl)thiocarbamoyl]isoxazole-4-carboxamide Formula: C22H21ClN4O5S2 MolecularWeight: 521.00894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H21ClN4O5S2/c1-14-19(20(26-32-14)17-4-2-3-5-18(17)23)21(28)25-22(33)24-15-6-8-16(9-7-15)34(29,30)27-10-12-31-13-11-27/h2-9H,10-13H2,1H3,(H2,24,25,28,33)