(2-phenyl-1,3-thiazol-4-yl)methyl 3-[(4-butylphenyl)sulfamoyl]benzoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-[(4-butylphenyl)sulfamoyl]benzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 3-[(4-butylphenyl)sulfamoyl]benzoate CAS Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-[(4-butylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C27H26N2O4S2 MolecularWeight: 506.63634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O4S2/c1-2-3-8-20-13-15-23(16-14-20)29-35(31,32)25-12-7-11-22(17-25)27(30)33-18-24-19-34-26(28-24)21-9-5-4-6-10-21/h4-7,9-17,19,29H,2-3,8,18H2,1H3