N-(3-fluorophenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3-fluorophenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(3-fluorophenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-triazole-4-carboxamide CAS Name: N-(3-fluorophenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-4-triazolecarboxamide IUPAC Name: N-(3-fluorophenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyltriazole-4-carboxamide Traditional Name: N-(3-fluorophenyl)-1-(3-phenylanthranil-5-yl)-5-propyl-triazole-4-carboxamide Formula: C25H20FN5O2 MolecularWeight: 441.457003

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=NN1C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

CCCC1=C(N=NN1C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C(=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C25H20FN5O2/c1-2-7-22-23(25(32)27-18-11-6-10-17(26)14-18)28-30-31(22)19-12-13-21-20(15-19)24(33-29-21)16-8-4-3-5-9-16/h3-6,8-15H,2,7H2,1H3,(H,27,32)