diethyl-[2-[(3S)-3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: diethyl-[2-[(3S)-3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: diethyl-[2-[(3S)-3-(4-fluorophenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]ammonium CAS Name: diethyl-[2-[(3S)-3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]ammonium IUPAC Name: diethyl-[2-[(3S)-3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]azanium Traditional Name: diethyl-[2-[(5S)-5-(4-fluorophenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethyl]ammonium Formula: C19H23FN3OS+ MolecularWeight: 360.468823

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(=O)N1C(CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)F

Isomeric SMILES

CC[NH+](CC)CC(=O)N1[C@@H](CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H22FN3OS/c1-3-22(4-2)13-19(24)23-17(14-7-9-15(20)10-8-14)12-16(21-23)18-6-5-11-25-18/h5-11,17H,3-4,12-13H2,1-2H3/p+1/t17-/m0/s1