N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pyrazine-2-carboxamide

Systemtic Name: N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pyrazine-2-carboxamide Openeye Name: N-[4-(3-pyridylmethylsulfanyl)phenyl]pyrazine-2-carboxamide CAS Name: N-[4-(3-pyridinylmethylthio)phenyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pyrazine-2-carboxamide Traditional Name: N-[4-(3-pyridylmethylthio)phenyl]pyrazinamide Formula: C17H14N4OS MolecularWeight: 322.38426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CSC2=CC=C(C=C2)NC(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CC(=CN=C1)CSC2=CC=C(C=C2)NC(=O)C3=NC=CN=C3

InChI

InChI=1S/C17H14N4OS/c22-17(16-11-19-8-9-20-16)21-14-3-5-15(6-4-14)23-12-13-2-1-7-18-10-13/h1-11H,12H2,(H,21,22)