2-azanyl-3-[2-[(4-methylpyridin-2-yl)amino]pentylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-[(4-methylpyridin-2-yl)amino]pentylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[2-[(4-methyl-2-pyridyl)amino]pentylsulfanyl]propanoic acid CAS Name: 2-amino-3-[2-[(4-methyl-2-pyridinyl)amino]pentylthio]propanoic acid IUPAC Name: 2-amino-3-[2-[(4-methylpyridin-2-yl)amino]pentylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[2-[(4-methyl-2-pyridyl)amino]pentylthio]propionic acid Formula: C14H23N3O2S MolecularWeight: 297.41632

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CSCC(C(=O)O)N)NC1=NC=CC(=C1)C

Isomeric SMILES

CCCC(CSCC(C(=O)O)N)NC1=NC=CC(=C1)C

InChI

InChI=1S/C14H23N3O2S/c1-3-4-11(8-20-9-12(15)14(18)19)17-13-7-10(2)5-6-16-13/h5-7,11-12H,3-4,8-9,15H2,1-2H3,(H,16,17)(H,18,19)