tert-butyl 2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylethanoate

Systemtic Name: tert-butyl 2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylethanoate Openeye Name: tert-butyl 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]acetate CAS Name: 2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylacetate Traditional Name: 2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]acetic acid tert-butyl ester Formula: C15H22N2O4S2 MolecularWeight: 358.47618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C15H22N2O4S2/c1-15(2,3)21-14(18)11-22-13-7-6-12(10-16-13)23(19,20)17-8-4-5-9-17/h6-7,10H,4-5,8-9,11H2,1-3H3