[5-azanyl-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] 4-ethylbenzoate

Systemtic Name: [5-azanyl-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] 4-ethylbenzoate Openeye Name: [5-amino-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [5-amino-1-(4-fluorophenyl)sulfonyl-3-pyrazolyl] ester IUPAC Name: [5-amino-1-(4-fluorophenyl)sulfonylpyrazol-3-yl] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [5-amino-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] ester Formula: C18H16FN3O4S MolecularWeight: 389.400743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OC2=NN(C(=C2)N)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OC2=NN(C(=C2)N)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN3O4S/c1-2-12-3-5-13(6-4-12)18(23)26-17-11-16(20)22(21-17)27(24,25)15-9-7-14(19)8-10-15/h3-11H,2,20H2,1H3