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

Systemtic Name: 2-(4-methyl-2-nitro-phenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide Openeye Name: 2-(4-methyl-2-nitro-phenoxy)-N-[[2-(p-tolyl)thiazol-4-yl]methyl]propanamide CAS Name: 2-(4-methyl-2-nitrophenoxy)-N-[[2-(4-methylphenyl)-4-thiazolyl]methyl]propanamide IUPAC Name: 2-(4-methyl-2-nitrophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide Traditional Name: 2-(4-methyl-2-nitro-phenoxy)-N-[[2-(p-tolyl)thiazol-4-yl]methyl]propionamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)CNC(=O)C(C)OC3=C(C=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)CNC(=O)C(C)OC3=C(C=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4S/c1-13-4-7-16(8-5-13)21-23-17(12-29-21)11-22-20(25)15(3)28-19-9-6-14(2)10-18(19)24(26)27/h4-10,12,15H,11H2,1-3H3,(H,22,25)