2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-N-[2-(4-chlorophenyl)ethyl]pyrazolidine-1-carbothioamide

Systemtic Name: 2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-N-[2-(4-chlorophenyl)ethyl]pyrazolidine-1-carbothioamide Openeye Name: 2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-N-[2-(4-chlorophenyl)ethyl]pyrazolidine-1-carbothioamide CAS Name: 2-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-N-[2-(4-chlorophenyl)ethyl]-1-pyrazolidinecarbothioamide IUPAC Name: 2-(5-tert-butyl-2-methylpyrazole-3-carbonyl)-N-[2-(4-chlorophenyl)ethyl]pyrazolidine-1-carbothioamide Traditional Name: 2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-N-[2-(4-chlorophenyl)ethyl]pyrazolidine-1-carbothioamide Formula: C21H28ClN5OS MolecularWeight: 433.99792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=S)NCCC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=S)NCCC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H28ClN5OS/c1-21(2,3)18-14-17(25(4)24-18)19(28)26-12-5-13-27(26)20(29)23-11-10-15-6-8-16(22)9-7-15/h6-9,14H,5,10-13H2,1-4H3,(H,23,29)