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

Systemtic Name: 5-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pyrazine-2-carboxamide Openeye Name: 5-methyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]pyrazine-2-carboxamide CAS Name: 5-methyl-N-[4-(3-pyridinylmethylthio)phenyl]-2-pyrazinecarboxamide IUPAC Name: 5-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pyrazine-2-carboxamide Traditional Name: 5-methyl-N-[4-(3-pyridylmethylthio)phenyl]pyrazinamide Formula: C18H16N4OS MolecularWeight: 336.41084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

InChI

InChI=1S/C18H16N4OS/c1-13-9-21-17(11-20-13)18(23)22-15-4-6-16(7-5-15)24-12-14-3-2-8-19-10-14/h2-11H,12H2,1H3,(H,22,23)