3-azanyl-N-[2-(phenylmethylsulfanyl)ethyl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[2-(phenylmethylsulfanyl)ethyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-(2-benzylsulfanylethyl)pyrazine-2-carboxamide CAS Name: 3-amino-N-[2-(phenylmethylthio)ethyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-(2-benzylsulfanylethyl)pyrazine-2-carboxamide Traditional Name: 3-amino-N-[2-(benzylthio)ethyl]pyrazinamide Formula: C14H16N4OS MolecularWeight: 288.36804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(=O)C2=NC=CN=C2N

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(=O)C2=NC=CN=C2N

InChI

InChI=1S/C14H16N4OS/c15-13-12(16-6-7-17-13)14(19)18-8-9-20-10-11-4-2-1-3-5-11/h1-7H,8-10H2,(H2,15,17)(H,18,19)