ethyl 4-oxidanylidene-4-[2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonyl]pyrazolidin-1-yl]butanoate

Systemtic Name: ethyl 4-oxidanylidene-4-[2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonyl]pyrazolidin-1-yl]butanoate Openeye Name: ethyl 4-oxo-4-[2-[2-(3-pyridyl)thiazole-4-carbonyl]pyrazolidin-1-yl]butanoate CAS Name: 4-oxo-4-[2-[oxo-[2-(3-pyridinyl)-4-thiazolyl]methyl]-1-pyrazolidinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[2-(2-pyridin-3-yl-1,3-thiazole-4-carbonyl)pyrazolidin-1-yl]butanoate Traditional Name: 4-keto-4-[2-[2-(3-pyridyl)thiazole-4-carbonyl]pyrazolidin-1-yl]butyric acid ethyl ester Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N1CCCN1C(=O)C2=CSC(=N2)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)CCC(=O)N1CCCN1C(=O)C2=CSC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C18H20N4O4S/c1-2-26-16(24)7-6-15(23)21-9-4-10-22(21)18(25)14-12-27-17(20-14)13-5-3-8-19-11-13/h3,5,8,11-12H,2,4,6-7,9-10H2,1H3