tert-butyl 2-[4-methyl-2-(pyridin-2-ylcarbonylamino)pentyl]sulfanylethanoate

Systemtic Name: tert-butyl 2-[4-methyl-2-(pyridin-2-ylcarbonylamino)pentyl]sulfanylethanoate Openeye Name: tert-butyl 2-[4-methyl-2-(pyridine-2-carbonylamino)pentyl]sulfanylacetate CAS Name: 2-[[4-methyl-2-[[oxo(2-pyridinyl)methyl]amino]pentyl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-methyl-2-(pyridine-2-carbonylamino)pentyl]sulfanylacetate Traditional Name: 2-[(4-methyl-2-picolinamido-pentyl)thio]acetic acid tert-butyl ester Formula: C18H28N2O3S MolecularWeight: 352.49152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CSCC(=O)OC(C)(C)C)NC(=O)C1=CC=CC=N1

Isomeric SMILES

CC(C)CC(CSCC(=O)OC(C)(C)C)NC(=O)C1=CC=CC=N1

InChI

InChI=1S/C18H28N2O3S/c1-13(2)10-14(11-24-12-16(21)23-18(3,4)5)20-17(22)15-8-6-7-9-19-15/h6-9,13-14H,10-12H2,1-5H3,(H,20,22)