[4-[[2-(2-azanylethanoyloxycarbothioyl)-4-propyl-phenyl]sulfamoyl]phenyl] 2,2-dimethylpropanoate

Systemtic Name: [4-[[2-(2-azanylethanoyloxycarbothioyl)-4-propyl-phenyl]sulfamoyl]phenyl] 2,2-dimethylpropanoate Openeye Name: [4-[[2-(2-aminoacetyl)oxycarbothioyl-4-propyl-phenyl]sulfamoyl]phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[[2-[(2-amino-1-oxoethoxy)-sulfanylidenemethyl]-4-propylphenyl]sulfamoyl]phenyl] ester IUPAC Name: [4-[[2-(2-aminoacetyl)oxycarbothioyl-4-propylphenyl]sulfamoyl]phenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[(2-glycyloxycarbothioyl-4-propyl-phenyl)sulfamoyl]phenyl] ester Formula: C23H28N2O6S2 MolecularWeight: 492.60822

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OC(=O)C(C)(C)C)C(=S)OC(=O)CN

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OC(=O)C(C)(C)C)C(=S)OC(=O)CN

InChI

InChI=1S/C23H28N2O6S2/c1-5-6-15-7-12-19(18(13-15)21(32)31-20(26)14-24)25-33(28,29)17-10-8-16(9-11-17)30-22(27)23(2,3)4/h7-13,25H,5-6,14,24H2,1-4H3