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

Systemtic Name: N-[2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazol-3-yl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[2-[4-(4-fluorophenyl)thiazol-2-yl]-5-methyl-pyrazol-3-yl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[2-[4-(4-fluorophenyl)-2-thiazolyl]-5-methyl-3-pyrazolyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[2-[4-(4-fluorophenyl)thiazol-2-yl]-5-methyl-pyrazol-3-yl]-4,5-dimethoxy-2-nitro-benzamide Formula: C22H18FN5O5S MolecularWeight: 483.472223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18FN5O5S/c1-12-8-20(25-21(29)15-9-18(32-2)19(33-3)10-17(15)28(30)31)27(26-12)22-24-16(11-34-22)13-4-6-14(23)7-5-13/h4-11H,1-3H3,(H,25,29)