N-[5-methyl-4-(4-propylphenyl)-1,3-thiazol-2-yl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[5-methyl-4-(4-propylphenyl)-1,3-thiazol-2-yl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[5-methyl-4-(4-propylphenyl)thiazol-2-yl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[5-methyl-4-(4-propylphenyl)-2-thiazolyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[5-methyl-4-(4-propylphenyl)-1,3-thiazol-2-yl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[5-methyl-4-(4-propylphenyl)thiazol-2-yl]-2-(2-nitrophenoxy)acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])C

InChI

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