3-azanyl-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[5-[(4-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[5-[(4-fluorobenzyl)thio]-1,3,4-thiadiazol-2-yl]pyrazinamide Formula: C14H11FN6OS2 MolecularWeight: 362.405143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN=C(S2)NC(=O)C3=NC=CN=C3N)F

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN=C(S2)NC(=O)C3=NC=CN=C3N)F

InChI

InChI=1S/C14H11FN6OS2/c15-9-3-1-8(2-4-9)7-23-14-21-20-13(24-14)19-12(22)10-11(16)18-6-5-17-10/h1-6H,7H2,(H2,16,18)(H,19,20,22)