[4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 4-(furan-2-ylcarbonylamino)butanoate

Systemtic Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 4-(furan-2-ylcarbonylamino)butanoate Openeye Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 4-(furan-2-carbonylamino)butanoate CAS Name: 4-[[2-furanyl(oxo)methyl]amino]butanoic acid [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] 4-(furan-2-carbonylamino)butanoate Traditional Name: 4-(2-furoylamino)butyric acid [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C24H26N2O6S MolecularWeight: 470.53804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)CCCNC(=O)C3=CC=CO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)CCCNC(=O)C3=CC=CO3)C

InChI

InChI=1S/C24H26N2O6S/c1-17-8-13-21(16-18(17)2)33(29,30)26(3)19-9-11-20(12-10-19)32-23(27)7-4-14-25-24(28)22-6-5-15-31-22/h5-6,8-13,15-16H,4,7,14H2,1-3H3,(H,25,28)