prop-2-enyl 3-(5-methyl-2-nitro-phenyl)-2-(2-pyridin-4-yl-1,3-thiazol-4-yl)propanoate

Systemtic Name: prop-2-enyl 3-(5-methyl-2-nitro-phenyl)-2-(2-pyridin-4-yl-1,3-thiazol-4-yl)propanoate Openeye Name: allyl 3-(5-methyl-2-nitro-phenyl)-2-[2-(4-pyridyl)thiazol-4-yl]propanoate CAS Name: 3-(5-methyl-2-nitrophenyl)-2-(2-pyridin-4-yl-4-thiazolyl)propanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 3-(5-methyl-2-nitrophenyl)-2-(2-pyridin-4-yl-1,3-thiazol-4-yl)propanoate Traditional Name: 3-(5-methyl-2-nitro-phenyl)-2-[2-(4-pyridyl)thiazol-4-yl]propionic acid allyl ester Formula: C21H19N3O4S MolecularWeight: 409.45826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O4S/c1-3-10-28-21(25)17(12-16-11-14(2)4-5-19(16)24(26)27)18-13-29-20(23-18)15-6-8-22-9-7-15/h3-9,11,13,17H,1,10,12H2,2H3