methyl 2-[[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]carbothioylamino]ethanoate

Systemtic Name: methyl 2-[[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]carbothioylamino]ethanoate Openeye Name: methyl 2-[[2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbothioyl]amino]acetate CAS Name: 2-[[[2-[oxo-(1-phenylcyclopropyl)methyl]-1-pyrazolidinyl]-sulfanylidenemethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbothioyl]amino]acetate Traditional Name: 2-[[2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbothioyl]amino]acetic acid methyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=S)N1CCCN1C(=O)C2(CC2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CNC(=S)N1CCCN1C(=O)C2(CC2)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3O3S/c1-23-14(21)12-18-16(24)20-11-5-10-19(20)15(22)17(8-9-17)13-6-3-2-4-7-13/h2-4,6-7H,5,8-12H2,1H3,(H,18,24)