3-(4-fluorophenyl)-N-phenethyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 3-(4-fluorophenyl)-N-phenethyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-(4-fluorophenyl)-N-phenethyl-5-(2-thienyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3-(4-fluorophenyl)-N-phenethyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 3-(4-fluorophenyl)-N-phenethyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-(4-fluorophenyl)-N-phenethyl-3-(2-thienyl)-2-pyrazoline-1-carbothioamide Formula: C22H20FN3S2 MolecularWeight: 409.542703

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CS2)C(=S)NCCC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(N(N=C1C2=CC=CS2)C(=S)NCCC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN3S2/c23-18-10-8-17(9-11-18)20-15-19(21-7-4-14-28-21)25-26(20)22(27)24-13-12-16-5-2-1-3-6-16/h1-11,14,20H,12-13,15H2,(H,24,27)