2-(3-azanylpyridin-4-yl)sulfanyl-N-[(5-bromanylthiophen-2-yl)methyl]-N-ethyl-ethanamide

Systemtic Name: 2-(3-azanylpyridin-4-yl)sulfanyl-N-[(5-bromanylthiophen-2-yl)methyl]-N-ethyl-ethanamide Openeye Name: 2-[(3-amino-4-pyridyl)sulfanyl]-N-[(5-bromo-2-thienyl)methyl]-N-ethyl-acetamide CAS Name: 2-[(3-amino-4-pyridinyl)thio]-N-[(5-bromo-2-thiophenyl)methyl]-N-ethylacetamide IUPAC Name: 2-(3-aminopyridin-4-yl)sulfanyl-N-[(5-bromothiophen-2-yl)methyl]-N-ethylacetamide Traditional Name: 2-[(3-amino-4-pyridyl)thio]-N-[(5-bromo-2-thienyl)methyl]-N-ethyl-acetamide Formula: C14H16BrN3OS2 MolecularWeight: 386.33034

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)C(=O)CSC2=C(C=NC=C2)N

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)C(=O)CSC2=C(C=NC=C2)N

InChI

InChI=1S/C14H16BrN3OS2/c1-2-18(8-10-3-4-13(15)21-10)14(19)9-20-12-5-6-17-7-11(12)16/h3-7H,2,8-9,16H2,1H3