methyl 3-[(4-fluorophenyl)sulfonylamino]-5-[(1,3-thiazol-5-ylcarbonylamino)methyl]benzoate

Systemtic Name: methyl 3-[(4-fluorophenyl)sulfonylamino]-5-[(1,3-thiazol-5-ylcarbonylamino)methyl]benzoate Openeye Name: methyl 3-[(4-fluorophenyl)sulfonylamino]-5-[(thiazole-5-carbonylamino)methyl]benzoate CAS Name: 3-[(4-fluorophenyl)sulfonylamino]-5-[[[oxo(5-thiazolyl)methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-fluorophenyl)sulfonylamino]-5-[(1,3-thiazole-5-carbonylamino)methyl]benzoate Traditional Name: 3-[(4-fluorophenyl)sulfonylamino]-5-[(thiazole-5-carbonylamino)methyl]benzoic acid methyl ester Formula: C19H16FN3O5S2 MolecularWeight: 449.475843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)F)CNC(=O)C3=CN=CS3

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)F)CNC(=O)C3=CN=CS3

InChI

InChI=1S/C19H16FN3O5S2/c1-28-19(25)13-6-12(9-22-18(24)17-10-21-11-29-17)7-15(8-13)23-30(26,27)16-4-2-14(20)3-5-16/h2-8,10-11,23H,9H2,1H3,(H,22,24)