methyl 2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propanoate

Systemtic Name: methyl 2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propanoate Openeye Name: methyl 2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propanoate CAS Name: 2-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonylamino]-3-(4-fluorophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propanoate Traditional Name: 2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propionic acid methyl ester Formula: C15H17ClFN3O4S MolecularWeight: 389.829583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)NC(CC2=CC=C(C=C2)F)C(=O)OC)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)NC(CC2=CC=C(C=C2)F)C(=O)OC)Cl)C

InChI

InChI=1S/C15H17ClFN3O4S/c1-9-13(14(16)20(2)18-9)25(22,23)19-12(15(21)24-3)8-10-4-6-11(17)7-5-10/h4-7,12,19H,8H2,1-3H3