5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[4-[[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophen-2-yl]methyl]-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[4-[[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophen-2-yl]methyl]-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 5-(3,5-dimethylisoxazol-4-yl)-3-[[4-[[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-thienyl]methyl]-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 5-(3,5-dimethyl-4-isoxazolyl)-3-[[4-[[5-[1-methyl-5-(trifluoromethyl)-3-pyrazolyl]-2-thiophenyl]methyl]-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole IUPAC Name: 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[4-[[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophen-2-yl]methyl]-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 5-(3,5-dimethylisoxazol-4-yl)-3-[[4-[[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-thienyl]methyl]-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole Formula: C23H26F3N7O2S MolecularWeight: 521.55845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C2=NC(=NO2)CN3CCCN(CC3)CC4=CC=C(S4)C5=NN(C(=C5)C(F)(F)F)C

Isomeric SMILES

CC1=C(C(=NO1)C)C2=NC(=NO2)CN3CCCN(CC3)CC4=CC=C(S4)C5=NN(C(=C5)C(F)(F)F)C

InChI

InChI=1S/C23H26F3N7O2S/c1-14-21(15(2)34-29-14)22-27-20(30-35-22)13-33-8-4-7-32(9-10-33)12-16-5-6-18(36-16)17-11-19(23(24,25)26)31(3)28-17/h5-6,11H,4,7-10,12-13H2,1-3H3