N-(furan-2-ylmethyl)-2-(1-phenylcyclopropyl)carbonyl-pyrazolidine-1-carbothioamide

Systemtic Name: N-(furan-2-ylmethyl)-2-(1-phenylcyclopropyl)carbonyl-pyrazolidine-1-carbothioamide Openeye Name: N-(2-furylmethyl)-2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-2-[oxo-(1-phenylcyclopropyl)methyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbothioamide Traditional Name: N-(2-furfuryl)-2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbothioamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=S)NCC2=CC=CO2)C(=O)C3(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(N(C1)C(=S)NCC2=CC=CO2)C(=O)C3(CC3)C4=CC=CC=C4

InChI

InChI=1S/C19H21N3O2S/c23-17(19(9-10-19)15-6-2-1-3-7-15)21-11-5-12-22(21)18(25)20-14-16-8-4-13-24-16/h1-4,6-8,13H,5,9-12,14H2,(H,20,25)