methyl 3-[(3-fluorophenyl)sulfonylamino]-4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: methyl 3-[(3-fluorophenyl)sulfonylamino]-4-(1,2,4-triazol-1-yl)benzoate Openeye Name: methyl 3-[(3-fluorophenyl)sulfonylamino]-4-(1,2,4-triazol-1-yl)benzoate CAS Name: 3-[(3-fluorophenyl)sulfonylamino]-4-(1,2,4-triazol-1-yl)benzoic acid methyl ester IUPAC Name: methyl 3-[(3-fluorophenyl)sulfonylamino]-4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 3-[(3-fluorophenyl)sulfonylamino]-4-(1,2,4-triazol-1-yl)benzoic acid methyl ester Formula: C16H13FN4O4S MolecularWeight: 376.362223

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2C=NC=N2)NS(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2C=NC=N2)NS(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C16H13FN4O4S/c1-25-16(22)11-5-6-15(21-10-18-9-19-21)14(7-11)20-26(23,24)13-4-2-3-12(17)8-13/h2-10,20H,1H3