2-(2-bromanyl-4-phenyl-phenoxy)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-(2-bromanyl-4-phenyl-phenoxy)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(2-bromo-4-phenyl-phenoxy)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-(2-bromo-4-phenylphenoxy)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-(2-bromo-4-phenylphenoxy)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-(2-bromo-4-phenyl-phenoxy)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]acetamide Formula: C21H22BrN3O2S MolecularWeight: 460.38728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br

InChI

InChI=1S/C21H22BrN3O2S/c1-3-14(4-2)20-24-25-21(28-20)23-19(26)13-27-18-11-10-16(12-17(18)22)15-8-6-5-7-9-15/h5-12,14H,3-4,13H2,1-2H3,(H,23,25,26)