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

Systemtic Name: N-(4-ethylphenyl)-N-[4-[(4-methyl-2-nitro-phenoxy)methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-(4-ethylphenyl)-N-[4-[(4-methyl-2-nitro-phenoxy)methyl]thiazol-2-yl]acetamide CAS Name: N-(4-ethylphenyl)-N-[4-[(4-methyl-2-nitrophenoxy)methyl]-2-thiazolyl]acetamide IUPAC Name: N-(4-ethylphenyl)-N-[4-[(4-methyl-2-nitrophenoxy)methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-(4-ethylphenyl)-N-[4-[(4-methyl-2-nitro-phenoxy)methyl]thiazol-2-yl]acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC3=C(C=C(C=C3)C)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC3=C(C=C(C=C3)C)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C21H21N3O4S/c1-4-16-6-8-18(9-7-16)23(15(3)25)21-22-17(13-29-21)12-28-20-10-5-14(2)11-19(20)24(26)27/h5-11,13H,4,12H2,1-3H3