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

Systemtic Name: N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-2-(2-propan-2-ylphenoxy)ethanamide Openeye Name: 2-(2-isopropylphenoxy)-N-[5-[(3-nitrophenyl)methyl]thiazol-2-yl]acetamide CAS Name: N-[5-[(3-nitrophenyl)methyl]-2-thiazolyl]-2-(2-propan-2-ylphenoxy)acetamide IUPAC Name: N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-2-(2-propan-2-ylphenoxy)acetamide Traditional Name: 2-(2-isopropylphenoxy)-N-[5-(3-nitrobenzyl)thiazol-2-yl]acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4S/c1-14(2)18-8-3-4-9-19(18)28-13-20(25)23-21-22-12-17(29-21)11-15-6-5-7-16(10-15)24(26)27/h3-10,12,14H,11,13H2,1-2H3,(H,22,23,25)