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

Systemtic Name: 5-bromanyl-4-tert-butyl-2-[[4-(5-methylsulfonylpentyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1,3-thiazole Openeye Name: 5-bromo-4-tert-butyl-2-[[4-(5-methylsulfonylpentyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]thiazole CAS Name: 5-bromo-4-tert-butyl-2-[[4-(5-methylsulfonylpentyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]thiazole IUPAC Name: 5-bromo-4-tert-butyl-2-[[4-(5-methylsulfonylpentyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1,3-thiazole Traditional Name: 5-bromo-4-tert-butyl-2-[[4-(5-mesylpentyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]thiazole Formula: C19H25BrN4O2S4 MolecularWeight: 549.5914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(N2CCCCCS(=O)(=O)C)C3=CC=CS3)Br

Isomeric SMILES

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(N2CCCCCS(=O)(=O)C)C3=CC=CS3)Br

InChI

InChI=1S/C19H25BrN4O2S4/c1-19(2,3)14-15(20)28-18(21-14)29-17-23-22-16(13-9-8-11-27-13)24(17)10-6-5-7-12-30(4,25)26/h8-9,11H,5-7,10,12H2,1-4H3