2-[azanyl-[6-[(2-methylpropan-2-yl)oxycarbonyl]pyridin-3-yl]methyl]-3-ethanoylsulfanyl-pentanoic acid

Systemtic Name: 2-[azanyl-[6-[(2-methylpropan-2-yl)oxycarbonyl]pyridin-3-yl]methyl]-3-ethanoylsulfanyl-pentanoic acid Openeye Name: 3-acetylsulfanyl-2-[amino-(6-tert-butoxycarbonyl-3-pyridyl)methyl]pentanoic acid CAS Name: 3-(acetylthio)-2-[amino-[6-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-pyridinyl]methyl]pentanoic acid IUPAC Name: 3-acetylsulfanyl-2-[amino-[6-[(2-methylpropan-2-yl)oxycarbonyl]pyridin-3-yl]methyl]pentanoic acid Traditional Name: 3-(acetylthio)-2-[amino-(6-tert-butoxycarbonyl-3-pyridyl)methyl]valeric acid Formula: C18H26N2O5S MolecularWeight: 382.47444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(C1=CN=C(C=C1)C(=O)OC(C)(C)C)N)C(=O)O)SC(=O)C

Isomeric SMILES

CCC(C(C(C1=CN=C(C=C1)C(=O)OC(C)(C)C)N)C(=O)O)SC(=O)C

InChI

InChI=1S/C18H26N2O5S/c1-6-13(26-10(2)21)14(16(22)23)15(19)11-7-8-12(20-9-11)17(24)25-18(3,4)5/h7-9,13-15H,6,19H2,1-5H3,(H,22,23)