N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-4-heptoxy-benzamide

Systemtic Name: N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[4-(cyclohexylsulfamoyl)anilino]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[4-(cyclohexylsulfamoyl)phenyl]thiocarbamoyl]-4-heptoxy-benzamide Formula: C27H37N3O4S2 MolecularWeight: 531.73038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3CCCCC3

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3CCCCC3

InChI

InChI=1S/C27H37N3O4S2/c1-2-3-4-5-9-20-34-24-16-12-21(13-17-24)26(31)29-27(35)28-22-14-18-25(19-15-22)36(32,33)30-23-10-7-6-8-11-23/h12-19,23,30H,2-11,20H2,1H3,(H2,28,29,31,35)