5-[[3-(5-bromanylthiophen-2-yl)-4-methyl-1,2,3-triazolidin-1-yl]methyl]-1,2-oxazole

Systemtic Name: 5-[[3-(5-bromanylthiophen-2-yl)-4-methyl-1,2,3-triazolidin-1-yl]methyl]-1,2-oxazole Openeye Name: 5-[[3-(5-bromo-2-thienyl)-4-methyl-triazolidin-1-yl]methyl]isoxazole CAS Name: 5-[[3-(5-bromo-2-thiophenyl)-4-methyl-1-triazolidinyl]methyl]isoxazole IUPAC Name: 5-[[3-(5-bromothiophen-2-yl)-4-methyltriazolidin-1-yl]methyl]-1,2-oxazole Traditional Name: 5-[[3-(5-bromo-2-thienyl)-4-methyl-triazolidin-1-yl]methyl]isoxazole Formula: C11H13BrN4OS MolecularWeight: 329.21612

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(NN1C2=CC=C(S2)Br)CC3=CC=NO3

Isomeric SMILES

CC1CN(NN1C2=CC=C(S2)Br)CC3=CC=NO3

InChI

InChI=1S/C11H13BrN4OS/c1-8-6-15(7-9-4-5-13-17-9)14-16(8)11-3-2-10(12)18-11/h2-5,8,14H,6-7H2,1H3