methyl 3-[5-azanyl-6-(2-methylpropoxy)pyridin-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[5-azanyl-6-(2-methylpropoxy)pyridin-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[(5-amino-6-isobutoxy-2-pyridyl)sulfanyl]propanoate CAS Name: 3-[[5-amino-6-(2-methylpropoxy)-2-pyridinyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[5-amino-6-(2-methylpropoxy)pyridin-2-yl]sulfanylpropanoate Traditional Name: 3-[(5-amino-6-isobutoxy-2-pyridyl)thio]propionic acid methyl ester Formula: C13H20N2O3S MolecularWeight: 284.3745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC(=N1)SCCC(=O)OC)N

Isomeric SMILES

CC(C)COC1=C(C=CC(=N1)SCCC(=O)OC)N

InChI

InChI=1S/C13H20N2O3S/c1-9(2)8-18-13-10(14)4-5-11(15-13)19-7-6-12(16)17-3/h4-5,9H,6-8,14H2,1-3H3