3-[2,5-bis(bromanyl)phenyl]-5-(4-octoxyphenyl)-2H-1,3,4-thiadiazole

Systemtic Name: 3-[2,5-bis(bromanyl)phenyl]-5-(4-octoxyphenyl)-2H-1,3,4-thiadiazole Openeye Name: 3-(2,5-dibromophenyl)-5-(4-octoxyphenyl)-2H-1,3,4-thiadiazole CAS Name: 3-(2,5-dibromophenyl)-5-(4-octoxyphenyl)-2H-1,3,4-thiadiazole IUPAC Name: 3-(2,5-dibromophenyl)-5-(4-octoxyphenyl)-2H-1,3,4-thiadiazole Traditional Name: 3-(2,5-dibromophenyl)-5-(4-octoxyphenyl)-2H-1,3,4-thiadiazole Formula: C22H26Br2N2OS MolecularWeight: 526.32764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NN(CS2)C3=C(C=CC(=C3)Br)Br

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NN(CS2)C3=C(C=CC(=C3)Br)Br

InChI

InChI=1S/C22H26Br2N2OS/c1-2-3-4-5-6-7-14-27-19-11-8-17(9-12-19)22-25-26(16-28-22)21-15-18(23)10-13-20(21)24/h8-13,15H,2-7,14,16H2,1H3