ethyl 3-[(2-pent-4-enoylpyrazolidin-1-yl)carbothioylamino]propanoate

Systemtic Name: ethyl 3-[(2-pent-4-enoylpyrazolidin-1-yl)carbothioylamino]propanoate Openeye Name: ethyl 3-[(2-pent-4-enoylpyrazolidine-1-carbothioyl)amino]propanoate CAS Name: 3-[[[2-(1-oxopent-4-enyl)-1-pyrazolidinyl]-sulfanylidenemethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(2-pent-4-enoylpyrazolidine-1-carbothioyl)amino]propanoate Traditional Name: 3-[(2-pent-4-enoylpyrazolidine-1-carbothioyl)amino]propionic acid ethyl ester Formula: C14H23N3O3S MolecularWeight: 313.41572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=S)N1CCCN1C(=O)CCC=C

Isomeric SMILES

CCOC(=O)CCNC(=S)N1CCCN1C(=O)CCC=C

InChI

InChI=1S/C14H23N3O3S/c1-3-5-7-12(18)16-10-6-11-17(16)14(21)15-9-8-13(19)20-4-2/h3H,1,4-11H2,2H3,(H,15,21)