3-azanyl-N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[2-[(5-bromo-2-thienyl)methylthio]ethyl]pyrazinamide Formula: C12H13BrN4OS2 MolecularWeight: 373.29182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C(=N1)C(=O)NCCSCC2=CC=C(S2)Br)N

Isomeric SMILES

C1=CN=C(C(=N1)C(=O)NCCSCC2=CC=C(S2)Br)N

InChI

InChI=1S/C12H13BrN4OS2/c13-9-2-1-8(20-9)7-19-6-5-17-12(18)10-11(14)16-4-3-15-10/h1-4H,5-7H2,(H2,14,16)(H,17,18)