1-(4-fluorophenyl)-5-methyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-5-methyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,4-triazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-5-methyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,4-triazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-5-methyl-N-[3-(1-pyrrolidinylmethyl)phenyl]-1,2,4-triazole-3-carboxamide IUPAC Name: 1-(4-fluorophenyl)-5-methyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,4-triazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-5-methyl-N-[3-(pyrrolidinomethyl)phenyl]-1,2,4-triazole-3-carboxamide Formula: C21H22FN5O MolecularWeight: 379.430683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC=CC(=C3)CN4CCCC4

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC=CC(=C3)CN4CCCC4

InChI

InChI=1S/C21H22FN5O/c1-15-23-20(25-27(15)19-9-7-17(22)8-10-19)21(28)24-18-6-4-5-16(13-18)14-26-11-2-3-12-26/h4-10,13H,2-3,11-12,14H2,1H3,(H,24,28)