methyl 6-[2-(3-methylsulfanylpropanoyl)pyrazolidin-1-yl]carbonylpyridine-3-carboxylate

Systemtic Name: methyl 6-[2-(3-methylsulfanylpropanoyl)pyrazolidin-1-yl]carbonylpyridine-3-carboxylate Openeye Name: methyl 6-[2-(3-methylsulfanylpropanoyl)pyrazolidine-1-carbonyl]pyridine-3-carboxylate CAS Name: 6-[[2-[3-(methylthio)-1-oxopropyl]-1-pyrazolidinyl]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-(3-methylsulfanylpropanoyl)pyrazolidine-1-carbonyl]pyridine-3-carboxylate Traditional Name: 6-[2-[3-(methylthio)propanoyl]pyrazolidine-1-carbonyl]nicotinic acid methyl ester Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C(=O)N2CCCN2C(=O)CCSC

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C(=O)N2CCCN2C(=O)CCSC

InChI

InChI=1S/C15H19N3O4S/c1-22-15(21)11-4-5-12(16-10-11)14(20)18-8-3-7-17(18)13(19)6-9-23-2/h4-5,10H,3,6-9H2,1-2H3