methyl 2-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]pyrazolidin-1-yl]carbothioylamino]ethanoate

Systemtic Name: methyl 2-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]pyrazolidin-1-yl]carbothioylamino]ethanoate Openeye Name: methyl 2-[[2-(3,5-dimethylisoxazole-4-carbonyl)pyrazolidine-1-carbothioyl]amino]acetate CAS Name: 2-[[[2-[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]-1-pyrazolidinyl]-sulfanylidenemethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(3,5-dimethyl-1,2-oxazole-4-carbonyl)pyrazolidine-1-carbothioyl]amino]acetate Traditional Name: 2-[[2-(3,5-dimethylisoxazole-4-carbonyl)pyrazolidine-1-carbothioyl]amino]acetic acid methyl ester Formula: C13H18N4O4S MolecularWeight: 326.37142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)N2CCCN2C(=S)NCC(=O)OC

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N2CCCN2C(=S)NCC(=O)OC

InChI

InChI=1S/C13H18N4O4S/c1-8-11(9(2)21-15-8)12(19)16-5-4-6-17(16)13(22)14-7-10(18)20-3/h4-7H2,1-3H3,(H,14,22)