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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=NN2C3=NC(=CS3)C4=CC=C(C=C4)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=NN2C3=NC(=CS3)C4=CC=C(C=C4)F)C)[N+](=O)[O-]

InChI

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