N-[4-(4-bromophenyl)-5-ethyl-1,3-thiazol-2-yl]-2-(2-methyl-4-nitro-phenoxy)ethanamide

Systemtic Name: N-[4-(4-bromophenyl)-5-ethyl-1,3-thiazol-2-yl]-2-(2-methyl-4-nitro-phenoxy)ethanamide Openeye Name: N-[4-(4-bromophenyl)-5-ethyl-thiazol-2-yl]-2-(2-methyl-4-nitro-phenoxy)acetamide CAS Name: N-[4-(4-bromophenyl)-5-ethyl-2-thiazolyl]-2-(2-methyl-4-nitrophenoxy)acetamide IUPAC Name: N-[4-(4-bromophenyl)-5-ethyl-1,3-thiazol-2-yl]-2-(2-methyl-4-nitrophenoxy)acetamide Traditional Name: N-[4-(4-bromophenyl)-5-ethyl-thiazol-2-yl]-2-(2-methyl-4-nitro-phenoxy)acetamide Formula: C20H18BrN3O4S MolecularWeight: 476.34362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=C(N=C(S1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H18BrN3O4S/c1-3-17-19(13-4-6-14(21)7-5-13)23-20(29-17)22-18(25)11-28-16-9-8-15(24(26)27)10-12(16)2/h4-10H,3,11H2,1-2H3,(H,22,23,25)