4-bromanyl-N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-N-methyl-benzamide

Systemtic Name: 4-bromanyl-N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-N-methyl-benzamide Openeye Name: 4-bromo-N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-N-methyl-benzamide CAS Name: 4-bromo-N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-N-methylbenzamide IUPAC Name: 4-bromo-N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-N-methylbenzamide Traditional Name: 4-bromo-N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-N-methyl-benzamide Formula: C20H20BrN3OS MolecularWeight: 430.3613

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(S2)N(C)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(S2)N(C)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrN3OS/c1-20(2,3)15-9-5-13(6-10-15)17-22-23-19(26-17)24(4)18(25)14-7-11-16(21)12-8-14/h5-12H,1-4H3