N-[(4-fluorophenyl)methyl]-2-methyl-5-oxidanylidene-pyrazolidine-1-carbothioamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-methyl-5-oxidanylidene-pyrazolidine-1-carbothioamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-methyl-5-oxo-pyrazolidine-1-carbothioamide CAS Name: N-[(4-fluorophenyl)methyl]-2-methyl-5-oxo-1-pyrazolidinecarbothioamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-methyl-5-oxopyrazolidine-1-carbothioamide Traditional Name: N-(4-fluorobenzyl)-5-keto-2-methyl-pyrazolidine-1-carbothioamide Formula: C12H14FN3OS MolecularWeight: 267.322463

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=O)N1C(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

CN1CCC(=O)N1C(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C12H14FN3OS/c1-15-7-6-11(17)16(15)12(18)14-8-9-2-4-10(13)5-3-9/h2-5H,6-8H2,1H3,(H,14,18)