N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(3-fluorophenyl)-1,3-benzoxazole-5-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(3-fluorophenyl)-1,3-benzoxazole-5-carboxamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(3-fluorophenyl)-1,3-benzoxazole-5-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-2-(3-fluorophenyl)-1,3-benzoxazole-5-carboxamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(3-fluorophenyl)-1,3-benzoxazole-5-carboxamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(3-fluorophenyl)-1,3-benzoxazole-5-carboxamide Formula: C22H21FN4O2 MolecularWeight: 392.426143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)F)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)F)C

InChI

InChI=1S/C22H21FN4O2/c1-14-11-15(2)27(26-14)10-4-9-24-21(28)16-7-8-20-19(13-16)25-22(29-20)17-5-3-6-18(23)12-17/h3,5-8,11-13H,4,9-10H2,1-2H3,(H,24,28)