N-[[5-[(2-chlorophenyl)sulfamoyl]-2-morpholin-4-yl-phenyl]carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[[5-[(2-chlorophenyl)sulfamoyl]-2-morpholin-4-yl-phenyl]carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[[5-[(2-chlorophenyl)sulfamoyl]-2-morpholino-phenyl]carbamothioyl]adamantane-1-carboxamide CAS Name: N-[[5-[(2-chlorophenyl)sulfamoyl]-2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[[5-[(2-chlorophenyl)sulfamoyl]-2-morpholin-4-ylphenyl]carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[[5-[(2-chlorophenyl)sulfamoyl]-2-morpholino-phenyl]thiocarbamoyl]adamantane-1-carboxamide Formula: C28H33ClN4O4S2 MolecularWeight: 589.16902

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3Cl)NC(=S)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3Cl)NC(=S)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H33ClN4O4S2/c29-22-3-1-2-4-23(22)32-39(35,36)21-5-6-25(33-7-9-37-10-8-33)24(14-21)30-27(38)31-26(34)28-15-18-11-19(16-28)13-20(12-18)17-28/h1-6,14,18-20,32H,7-13,15-17H2,(H2,30,31,34,38)