4-(2-bromanyl-4-propan-2-yl-phenoxy)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: 4-(2-bromanyl-4-propan-2-yl-phenoxy)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: 4-(2-bromo-4-isopropyl-phenoxy)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butanamide CAS Name: 4-(2-bromo-4-propan-2-ylphenoxy)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: 4-(2-bromo-4-propan-2-ylphenoxy)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: 4-(2-bromo-4-isopropyl-phenoxy)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butyramide Formula: C21H28BrN3O2S MolecularWeight: 466.43492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=NN=C(S2)C3CCCCC3)Br

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=NN=C(S2)C3CCCCC3)Br

InChI

InChI=1S/C21H28BrN3O2S/c1-14(2)16-10-11-18(17(22)13-16)27-12-6-9-19(26)23-21-25-24-20(28-21)15-7-4-3-5-8-15/h10-11,13-15H,3-9,12H2,1-2H3,(H,23,25,26)