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

Systemtic Name: 5-bromanyl-4-tert-butyl-2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazole Openeye Name: 5-bromo-4-tert-butyl-2-[[4-phenethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]thiazole CAS Name: 5-bromo-4-tert-butyl-2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]thiazole IUPAC Name: 5-bromo-4-tert-butyl-2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazole Traditional Name: 5-bromo-4-tert-butyl-2-[[4-phenethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]thiazole Formula: C21H21BrN4S3 MolecularWeight: 505.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(N2CCC3=CC=CC=C3)C4=CC=CS4)Br

Isomeric SMILES

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(N2CCC3=CC=CC=C3)C4=CC=CS4)Br

InChI

InChI=1S/C21H21BrN4S3/c1-21(2,3)16-17(22)28-20(23-16)29-19-25-24-18(15-10-7-13-27-15)26(19)12-11-14-8-5-4-6-9-14/h4-10,13H,11-12H2,1-3H3