2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[4-(4-nitrophenyl)thiazol-2-yl]acetamide CAS Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[4-(4-nitrophenyl)-2-thiazolyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[4-(4-nitrophenyl)thiazol-2-yl]acetamide Formula: C21H20BrN3O4S MolecularWeight: 490.3702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20BrN3O4S/c1-12(2)16-9-17(22)13(3)8-19(16)29-10-20(26)24-21-23-18(11-30-21)14-4-6-15(7-5-14)25(27)28/h4-9,11-12H,10H2,1-3H3,(H,23,24,26)