2-[(5-bromanyl-4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-5-(phenylmethyl)-1,3,4-thiadiazole

Systemtic Name: 2-[(5-bromanyl-4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-5-(phenylmethyl)-1,3,4-thiadiazole Openeye Name: 2-benzyl-5-(5-bromo-4-tert-butyl-thiazol-2-yl)sulfanyl-1,3,4-thiadiazole CAS Name: 2-[(5-bromo-4-tert-butyl-2-thiazolyl)thio]-5-(phenylmethyl)-1,3,4-thiadiazole IUPAC Name: 2-benzyl-5-[(5-bromo-4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazole Traditional Name: 2-benzyl-5-[(5-bromo-4-tert-butyl-thiazol-2-yl)thio]-1,3,4-thiadiazole Formula: C16H16BrN3S3 MolecularWeight: 426.41734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(S2)CC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(S2)CC3=CC=CC=C3)Br

InChI

InChI=1S/C16H16BrN3S3/c1-16(2,3)12-13(17)22-14(18-12)23-15-20-19-11(21-15)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3