3-(2,5-dimethoxyphenyl)-N-[4-(4-methyl-3-nitro-phenyl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-(2,5-dimethoxyphenyl)-N-[4-(4-methyl-3-nitro-phenyl)-1,3-thiazol-2-yl]propanamide Openeye Name: 3-(2,5-dimethoxyphenyl)-N-[4-(4-methyl-3-nitro-phenyl)thiazol-2-yl]propanamide CAS Name: 3-(2,5-dimethoxyphenyl)-N-[4-(4-methyl-3-nitrophenyl)-2-thiazolyl]propanamide IUPAC Name: 3-(2,5-dimethoxyphenyl)-N-[4-(4-methyl-3-nitrophenyl)-1,3-thiazol-2-yl]propanamide Traditional Name: 3-(2,5-dimethoxyphenyl)-N-[4-(4-methyl-3-nitro-phenyl)thiazol-2-yl]propionamide Formula: C21H21N3O5S MolecularWeight: 427.47354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCC3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCC3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5S/c1-13-4-5-14(11-18(13)24(26)27)17-12-30-21(22-17)23-20(25)9-6-15-10-16(28-2)7-8-19(15)29-3/h4-5,7-8,10-12H,6,9H2,1-3H3,(H,22,23,25)