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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(C2=NC(=CS2)COC3=CC(=C(C=C3)[N+](=O)[O-])C)C(=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N(C2=NC(=CS2)COC3=CC(=C(C=C3)[N+](=O)[O-])C)C(=O)C)C

InChI

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