N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-(3-methyl-4-nitro-phenoxy)ethanamide

Systemtic Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-(3-methyl-4-nitro-phenoxy)ethanamide Openeye Name: N-[4-(4-bromophenyl)thiazol-2-yl]-2-(3-methyl-4-nitro-phenoxy)acetamide CAS Name: N-[4-(4-bromophenyl)-2-thiazolyl]-2-(3-methyl-4-nitrophenoxy)acetamide IUPAC Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-(3-methyl-4-nitrophenoxy)acetamide Traditional Name: N-[4-(4-bromophenyl)thiazol-2-yl]-2-(3-methyl-4-nitro-phenoxy)acetamide Formula: C18H14BrN3O4S MolecularWeight: 448.29046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H14BrN3O4S/c1-11-8-14(6-7-16(11)22(24)25)26-9-17(23)21-18-20-15(10-27-18)12-2-4-13(19)5-3-12/h2-8,10H,9H2,1H3,(H,20,21,23)