N-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-[1-(4-fluorophenyl)pyrazol-4-yl]-N-methyl-methanamine

Systemtic Name: N-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-[1-(4-fluorophenyl)pyrazol-4-yl]-N-methyl-methanamine Openeye Name: N-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-[1-(4-fluorophenyl)pyrazol-4-yl]-N-methyl-methanamine CAS Name: N-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-[1-(4-fluorophenyl)-4-pyrazolyl]-N-methylmethanamine IUPAC Name: N-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-[1-(4-fluorophenyl)pyrazol-4-yl]-N-methylmethanamine Traditional Name: [3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl-[[1-(4-fluorophenyl)pyrazol-4-yl]methyl]-methyl-amine Formula: C21H18FN5O3 MolecularWeight: 407.397723

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=C(C=C2)F)CC3=NC(=NO3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=C(C=C2)F)CC3=NC(=NO3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H18FN5O3/c1-26(10-14-9-23-27(11-14)17-5-3-16(22)4-6-17)12-20-24-21(25-30-20)15-2-7-18-19(8-15)29-13-28-18/h2-9,11H,10,12-13H2,1H3