N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]-3-phenethyloxy-benzamide

Systemtic Name: N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]-3-phenethyloxy-benzamide Openeye Name: 3-phenethyloxy-N-[[4-(tetrahydrofuran-2-ylmethylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-(2-oxolanylmethylsulfamoyl)anilino]-sulfanylidenemethyl]-3-phenethyloxybenzamide IUPAC Name: N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]-3-phenethyloxybenzamide Traditional Name: 3-phenethyloxy-N-[[4-(tetrahydrofurfurylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C27H29N3O5S2 MolecularWeight: 539.66626

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O5S2/c31-26(21-8-4-9-23(18-21)35-17-15-20-6-2-1-3-7-20)30-27(36)29-22-11-13-25(14-12-22)37(32,33)28-19-24-10-5-16-34-24/h1-4,6-9,11-14,18,24,28H,5,10,15-17,19H2,(H2,29,30,31,36)