2-(6-azanylpyridin-3-yl)sulfanyl-N-[(5-bromanylthiophen-2-yl)methyl]-N-ethyl-ethanamide

Systemtic Name: 2-(6-azanylpyridin-3-yl)sulfanyl-N-[(5-bromanylthiophen-2-yl)methyl]-N-ethyl-ethanamide Openeye Name: 2-[(6-amino-3-pyridyl)sulfanyl]-N-[(5-bromo-2-thienyl)methyl]-N-ethyl-acetamide CAS Name: 2-[(6-amino-3-pyridinyl)thio]-N-[(5-bromo-2-thiophenyl)methyl]-N-ethylacetamide IUPAC Name: 2-(6-aminopyridin-3-yl)sulfanyl-N-[(5-bromothiophen-2-yl)methyl]-N-ethylacetamide Traditional Name: 2-[(6-amino-3-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=CN=C(C=C2)N

Isomeric SMILES

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

InChI

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