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

Systemtic Name: 4,5-dimethoxy-N-[5-methyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazol-3-yl]-2-nitro-benzamide Openeye Name: 4,5-dimethoxy-N-[5-methyl-2-(4-phenylthiazol-2-yl)pyrazol-3-yl]-2-nitro-benzamide CAS Name: 4,5-dimethoxy-N-[5-methyl-2-(4-phenyl-2-thiazolyl)-3-pyrazolyl]-2-nitrobenzamide IUPAC Name: 4,5-dimethoxy-N-[5-methyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazol-3-yl]-2-nitrobenzamide Traditional Name: 4,5-dimethoxy-N-[5-methyl-2-(4-phenylthiazol-2-yl)pyrazol-3-yl]-2-nitro-benzamide Formula: C22H19N5O5S MolecularWeight: 465.48176

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H19N5O5S/c1-13-9-20(26(25-13)22-23-16(12-33-22)14-7-5-4-6-8-14)24-21(28)15-10-18(31-2)19(32-3)11-17(15)27(29)30/h4-12H,1-3H3,(H,24,28)