2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-N-(pyridin-3-ylmethyl)pyrazolidine-1-carbothioamide

Systemtic Name: 2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-N-(pyridin-3-ylmethyl)pyrazolidine-1-carbothioamide Openeye Name: 2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-N-(3-pyridylmethyl)pyrazolidine-1-carbothioamide CAS Name: 2-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-N-(3-pyridinylmethyl)-1-pyrazolidinecarbothioamide IUPAC Name: 2-(5-tert-butyl-2-methylpyrazole-3-carbonyl)-N-(pyridin-3-ylmethyl)pyrazolidine-1-carbothioamide Traditional Name: 2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-N-(3-pyridylmethyl)pyrazolidine-1-carbothioamide Formula: C19H26N6OS MolecularWeight: 386.51434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=S)NCC3=CN=CC=C3)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=S)NCC3=CN=CC=C3)C

InChI

InChI=1S/C19H26N6OS/c1-19(2,3)16-11-15(23(4)22-16)17(26)24-9-6-10-25(24)18(27)21-13-14-7-5-8-20-12-14/h5,7-8,11-12H,6,9-10,13H2,1-4H3,(H,21,27)