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

Systemtic Name: 4-fluoranyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzothiophene-2-carboxamide Formula: C18H13FN4OS MolecularWeight: 352.385423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4)F

Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4)F

InChI

InChI=1S/C18H13FN4OS/c19-15-2-1-3-16-14(15)8-17(25-16)18(24)22-13-6-4-12(5-7-13)9-23-11-20-10-21-23/h1-8,10-11H,9H2,(H,22,24)