1-(4-fluorophenyl)-N-[(2-imidazol-1-ylpyridin-4-yl)methyl]-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-N-[(2-imidazol-1-ylpyridin-4-yl)methyl]-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-[(2-imidazol-1-yl-4-pyridyl)methyl]-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-N-[[2-(1-imidazolyl)-4-pyridinyl]methyl]-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: 1-(4-fluorophenyl)-N-[(2-imidazol-1-ylpyridin-4-yl)methyl]-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-[(2-imidazol-1-yl-4-pyridyl)methyl]-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C22H16FN7OS MolecularWeight: 445.472143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NN2C3=CC=C(C=C3)F)C(=O)NCC4=CC(=NC=C4)N5C=CN=C5

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NN2C3=CC=C(C=C3)F)C(=O)NCC4=CC(=NC=C4)N5C=CN=C5

InChI

InChI=1S/C22H16FN7OS/c23-16-3-5-17(6-4-16)30-21(18-2-1-11-32-18)27-20(28-30)22(31)26-13-15-7-8-25-19(12-15)29-10-9-24-14-29/h1-12,14H,13H2,(H,26,31)