3-phenylpropyl 5-[[4-(furan-2-ylmethylsulfamoyl)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[[4-(furan-2-ylmethylsulfamoyl)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[4-(2-furylmethylsulfamoyl)anilino]-5-oxo-pentanoate CAS Name: 5-[4-(2-furanylmethylsulfamoyl)anilino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[4-(furan-2-ylmethylsulfamoyl)anilino]-5-oxopentanoate Traditional Name: 5-[4-(2-furfurylsulfamoyl)anilino]-5-keto-valeric acid 3-phenylpropyl ester Formula: C25H28N2O6S MolecularWeight: 484.56462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

InChI

InChI=1S/C25H28N2O6S/c28-24(11-4-12-25(29)33-18-5-9-20-7-2-1-3-8-20)27-21-13-15-23(16-14-21)34(30,31)26-19-22-10-6-17-32-22/h1-3,6-8,10,13-17,26H,4-5,9,11-12,18-19H2,(H,27,28)