5-bromanyl-4-tert-butyl-2-[[4-(4-phenoxyphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1,3-thiazole

Systemtic Name: 5-bromanyl-4-tert-butyl-2-[[4-(4-phenoxyphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1,3-thiazole Openeye Name: 5-bromo-4-tert-butyl-2-[[4-(4-phenoxyphenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]thiazole CAS Name: 5-bromo-4-tert-butyl-2-[[4-(4-phenoxyphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]thiazole IUPAC Name: 5-bromo-4-tert-butyl-2-[[4-(4-phenoxyphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1,3-thiazole Traditional Name: 5-bromo-4-tert-butyl-2-[[4-(4-phenoxyphenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]thiazole Formula: C25H21BrN4OS3 MolecularWeight: 569.55944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(N2C3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=CS5)Br

Isomeric SMILES

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(N2C3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=CS5)Br

InChI

InChI=1S/C25H21BrN4OS3/c1-25(2,3)20-21(26)33-24(27-20)34-23-29-28-22(19-10-7-15-32-19)30(23)16-11-13-18(14-12-16)31-17-8-5-4-6-9-17/h4-15H,1-3H3