N-[2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazol-3-yl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazol-3-yl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-[4-(4-fluorophenyl)thiazol-2-yl]-5-methyl-pyrazol-3-yl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-[4-(4-fluorophenyl)-2-thiazolyl]-5-methyl-3-pyrazolyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-[4-(4-fluorophenyl)thiazol-2-yl]-5-methyl-pyrazol-3-yl]-2-methyl-3-nitro-benzamide Formula: C21H16FN5O3S MolecularWeight: 437.446843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)C3=NC(=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)C3=NC(=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN5O3S/c1-12-10-19(24-20(28)16-4-3-5-18(13(16)2)27(29)30)26(25-12)21-23-17(11-31-21)14-6-8-15(22)9-7-14/h3-11H,1-2H3,(H,24,28)