2-butoxy-N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-butoxy-N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 2-butoxy-N-[[4-(tetrahydrofuran-2-ylmethylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 2-butoxy-N-[[4-(2-oxolanylmethylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-butoxy-N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 2-butoxy-N-[[4-(tetrahydrofurfurylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C23H29N3O5S2 MolecularWeight: 491.62346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCC3CCCO3

Isomeric SMILES

CCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCC3CCCO3

InChI

InChI=1S/C23H29N3O5S2/c1-2-3-14-31-21-9-5-4-8-20(21)22(27)26-23(32)25-17-10-12-19(13-11-17)33(28,29)24-16-18-7-6-15-30-18/h4-5,8-13,18,24H,2-3,6-7,14-16H2,1H3,(H2,25,26,27,32)