[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-[(4-butylphenyl)sulfamoyl]benzoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-[(4-butylphenyl)sulfamoyl]benzoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 3-[(4-butylphenyl)sulfamoyl]benzoate CAS Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-[(4-butylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C23H29N3O6S/c1-4-5-7-16-10-12-18(13-11-16)26-33(30,31)19-9-6-8-17(14-19)22(28)32-20(15(2)3)21(27)25-23(24)29/h6,8-15,20,26H,4-5,7H2,1-3H3,(H3,24,25,27,29)