N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-3-cyclohexyl-propanamide

Systemtic Name: N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-3-cyclohexyl-propanamide Openeye Name: 3-cyclohexyl-N-[[4-(sec-butylsulfamoyl)phenyl]carbamothioyl]propanamide CAS Name: N-[[4-(butan-2-ylsulfamoyl)anilino]-sulfanylidenemethyl]-3-cyclohexylpropanamide IUPAC Name: N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-3-cyclohexylpropanamide Traditional Name: 3-cyclohexyl-N-[[4-(sec-butylsulfamoyl)phenyl]thiocarbamoyl]propionamide Formula: C20H31N3O3S2 MolecularWeight: 425.60844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2CCCCC2

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2CCCCC2

InChI

InChI=1S/C20H31N3O3S2/c1-3-15(2)23-28(25,26)18-12-10-17(11-13-18)21-20(27)22-19(24)14-9-16-7-5-4-6-8-16/h10-13,15-16,23H,3-9,14H2,1-2H3,(H2,21,22,24,27)