N-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[4-[(4-ethoxyphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[4-(p-phenetylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C27H31N3O5S2 MolecularWeight: 541.68214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C27H31N3O5S2/c1-3-5-6-19-35-24-13-7-20(8-14-24)26(31)29-27(36)28-21-11-17-25(18-12-21)37(32,33)30-22-9-15-23(16-10-22)34-4-2/h7-18,30H,3-6,19H2,1-2H3,(H2,28,29,31,36)