N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-4-heptoxy-benzamide

Systemtic Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[4-[ethyl(phenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]thiocarbamoyl]-4-heptoxy-benzamide Formula: C29H35N3O4S2 MolecularWeight: 553.7359

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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)N(CC)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N(CC)C3=CC=CC=C3

InChI

InChI=1S/C29H35N3O4S2/c1-3-5-6-7-11-22-36-26-18-14-23(15-19-26)28(33)31-29(37)30-24-16-20-27(21-17-24)38(34,35)32(4-2)25-12-9-8-10-13-25/h8-10,12-21H,3-7,11,22H2,1-2H3,(H2,30,31,33,37)