2-(3-azanylpyridin-4-yl)sulfanyl-N-pentyl-propanamide

Systemtic Name: 2-(3-azanylpyridin-4-yl)sulfanyl-N-pentyl-propanamide Openeye Name: 2-[(3-amino-4-pyridyl)sulfanyl]-N-pentyl-propanamide CAS Name: 2-[(3-amino-4-pyridinyl)thio]-N-pentylpropanamide IUPAC Name: 2-(3-aminopyridin-4-yl)sulfanyl-N-pentylpropanamide Traditional Name: 2-[(3-amino-4-pyridyl)thio]-N-amyl-propionamide Formula: C13H21N3OS MolecularWeight: 267.39034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(C)SC1=C(C=NC=C1)N

Isomeric SMILES

CCCCCNC(=O)C(C)SC1=C(C=NC=C1)N

InChI

InChI=1S/C13H21N3OS/c1-3-4-5-7-16-13(17)10(2)18-12-6-8-15-9-11(12)14/h6,8-10H,3-5,7,14H2,1-2H3,(H,16,17)