4-(2-bromanyl-4-tert-butyl-phenoxy)-N-[4-(4-butoxyphenyl)-1,3-thiazol-2-yl]butanamide

Systemtic Name: 4-(2-bromanyl-4-tert-butyl-phenoxy)-N-[4-(4-butoxyphenyl)-1,3-thiazol-2-yl]butanamide Openeye Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-[4-(4-butoxyphenyl)thiazol-2-yl]butanamide CAS Name: 4-(2-bromo-4-tert-butylphenoxy)-N-[4-(4-butoxyphenyl)-2-thiazolyl]butanamide IUPAC Name: 4-(2-bromo-4-tert-butylphenoxy)-N-[4-(4-butoxyphenyl)-1,3-thiazol-2-yl]butanamide Traditional Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-[4-(4-butoxyphenyl)thiazol-2-yl]butyramide Formula: C27H33BrN2O3S MolecularWeight: 545.53152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCOC3=C(C=C(C=C3)C(C)(C)C)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCOC3=C(C=C(C=C3)C(C)(C)C)Br

InChI

InChI=1S/C27H33BrN2O3S/c1-5-6-15-32-21-12-9-19(10-13-21)23-18-34-26(29-23)30-25(31)8-7-16-33-24-14-11-20(17-22(24)28)27(2,3)4/h9-14,17-18H,5-8,15-16H2,1-4H3,(H,29,30,31)