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

Systemtic Name: 4-bromanyl-N-[5-(4-heptylphenyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-bromo-N-[5-(4-heptylphenyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-bromo-N-[5-(4-heptylphenyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-bromo-N-[5-(4-heptylphenyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-bromo-N-[5-(4-heptylphenyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H24BrN3OS MolecularWeight: 458.41446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H24BrN3OS/c1-2-3-4-5-6-7-16-8-10-18(11-9-16)21-25-26-22(28-21)24-20(27)17-12-14-19(23)15-13-17/h8-15H,2-7H2,1H3,(H,24,26,27)