4-fluoranyl-N-[4-(1,2,4-triazol-1-yl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-N-[4-(1,2,4-triazol-1-yl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-N-[4-(1,2,4-triazol-1-yl)phenyl]benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-[4-(1,2,4-triazol-1-yl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-N-[4-(1,2,4-triazol-1-yl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-[4-(1,2,4-triazol-1-yl)phenyl]benzothiophene-2-carboxamide Formula: C17H11FN4OS MolecularWeight: 338.358843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=O)NC3=CC=C(C=C3)N4C=NC=N4)F

Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=O)NC3=CC=C(C=C3)N4C=NC=N4)F

InChI

InChI=1S/C17H11FN4OS/c18-14-2-1-3-15-13(14)8-16(24-15)17(23)21-11-4-6-12(7-5-11)22-10-19-9-20-22/h1-10H,(H,21,23)