2-(2-bromophenyl)-5-(4-heptylphenyl)-1,3,4-thiadiazole

Systemtic Name: 2-(2-bromophenyl)-5-(4-heptylphenyl)-1,3,4-thiadiazole Openeye Name: 2-(2-bromophenyl)-5-(4-heptylphenyl)-1,3,4-thiadiazole CAS Name: 2-(2-bromophenyl)-5-(4-heptylphenyl)-1,3,4-thiadiazole IUPAC Name: 2-(2-bromophenyl)-5-(4-heptylphenyl)-1,3,4-thiadiazole Traditional Name: 2-(2-bromophenyl)-5-(4-heptylphenyl)-1,3,4-thiadiazole Formula: C21H23BrN2S MolecularWeight: 415.38972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=CC=C3Br

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=CC=C3Br

InChI

InChI=1S/C21H23BrN2S/c1-2-3-4-5-6-9-16-12-14-17(15-13-16)20-23-24-21(25-20)18-10-7-8-11-19(18)22/h7-8,10-15H,2-6,9H2,1H3