ethyl 3-[[2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpyrazolidin-1-yl]carbothioylamino]propanoate

Systemtic Name: ethyl 3-[[2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpyrazolidin-1-yl]carbothioylamino]propanoate Openeye Name: ethyl 3-[[2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)pyrazolidine-1-carbothioyl]amino]propanoate CAS Name: 3-[[[2-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-1-pyrazolidinyl]-sulfanylidenemethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(5-tert-butyl-2-methylpyrazole-3-carbonyl)pyrazolidine-1-carbothioyl]amino]propanoate Traditional Name: 3-[[2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)pyrazolidine-1-carbothioyl]amino]propionic acid ethyl ester Formula: C18H29N5O3S MolecularWeight: 395.51956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=S)N1CCCN1C(=O)C2=CC(=NN2C)C(C)(C)C

Isomeric SMILES

CCOC(=O)CCNC(=S)N1CCCN1C(=O)C2=CC(=NN2C)C(C)(C)C

InChI

InChI=1S/C18H29N5O3S/c1-6-26-15(24)8-9-19-17(27)23-11-7-10-22(23)16(25)13-12-14(18(2,3)4)20-21(13)5/h12H,6-11H2,1-5H3,(H,19,27)