(3R)-5-(4-bromophenyl)-3-(2-fluorophenyl)-N-methyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: (3R)-5-(4-bromophenyl)-3-(2-fluorophenyl)-N-methyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: (3R)-5-(4-bromophenyl)-3-(2-fluorophenyl)-N-methyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: (3R)-5-(4-bromophenyl)-3-(2-fluorophenyl)-N-methyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: (3R)-5-(4-bromophenyl)-3-(2-fluorophenyl)-N-methyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: (5R)-3-(4-bromophenyl)-5-(2-fluorophenyl)-N-methyl-2-pyrazoline-1-carbothioamide Formula: C17H15BrFN3S MolecularWeight: 392.288503

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(CC(=N1)C2=CC=C(C=C2)Br)C3=CC=CC=C3F

Isomeric SMILES

CNC(=S)N1[C@H](CC(=N1)C2=CC=C(C=C2)Br)C3=CC=CC=C3F

InChI

InChI=1S/C17H15BrFN3S/c1-20-17(23)22-16(13-4-2-3-5-14(13)19)10-15(21-22)11-6-8-12(18)9-7-11/h2-9,16H,10H2,1H3,(H,20,23)/t16-/m1/s1