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

Systemtic Name: 2-[(5-bromanyl-4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-5-phenethyl-1,3,4-thiadiazole Openeye Name: 2-(5-bromo-4-tert-butyl-thiazol-2-yl)sulfanyl-5-phenethyl-1,3,4-thiadiazole CAS Name: 2-[(5-bromo-4-tert-butyl-2-thiazolyl)thio]-5-phenethyl-1,3,4-thiadiazole IUPAC Name: 2-[(5-bromo-4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-5-phenethyl-1,3,4-thiadiazole Traditional Name: 2-[(5-bromo-4-tert-butyl-thiazol-2-yl)thio]-5-phenethyl-1,3,4-thiadiazole Formula: C17H18BrN3S3 MolecularWeight: 440.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(S2)CCC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(S2)CCC3=CC=CC=C3)Br

InChI

InChI=1S/C17H18BrN3S3/c1-17(2,3)13-14(18)23-15(19-13)24-16-21-20-12(22-16)10-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3