N-[3-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-methyl-butanamide

Systemtic Name: N-[3-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-methyl-butanamide Openeye Name: N-[3-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-methyl-butanamide CAS Name: N-[3-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-methylbutanamide IUPAC Name: N-[3-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-methylbutanamide Traditional Name: N-[3-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-methyl-butyramide Formula: C21H23FN4O2 MolecularWeight: 382.431323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC=CC=C2F)C3=CC(=CC=C3)NC(=O)CC(C)C

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC=CC=C2F)C3=CC(=CC=C3)NC(=O)CC(C)C

InChI

InChI=1S/C21H23FN4O2/c1-4-28-21-24-20(17-10-5-6-11-18(17)22)26(25-21)16-9-7-8-15(13-16)23-19(27)12-14(2)3/h5-11,13-14H,4,12H2,1-3H3,(H,23,27)