methyl 5-oxidanylidene-5-[2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonyl]pyrazolidin-1-yl]pentanoate

Systemtic Name: methyl 5-oxidanylidene-5-[2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonyl]pyrazolidin-1-yl]pentanoate Openeye Name: methyl 5-oxo-5-[2-[2-(3-pyridyl)thiazole-4-carbonyl]pyrazolidin-1-yl]pentanoate CAS Name: 5-oxo-5-[2-[oxo-[2-(3-pyridinyl)-4-thiazolyl]methyl]-1-pyrazolidinyl]pentanoic acid methyl ester IUPAC Name: methyl 5-oxo-5-[2-(2-pyridin-3-yl-1,3-thiazole-4-carbonyl)pyrazolidin-1-yl]pentanoate Traditional Name: 5-keto-5-[2-[2-(3-pyridyl)thiazole-4-carbonyl]pyrazolidin-1-yl]valeric acid methyl ester Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)N1CCCN1C(=O)C2=CSC(=N2)C3=CN=CC=C3

Isomeric SMILES

COC(=O)CCCC(=O)N1CCCN1C(=O)C2=CSC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C18H20N4O4S/c1-26-16(24)7-2-6-15(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