N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-3,4,5-triethoxy-benzamide

Systemtic Name: N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-3,4,5-triethoxy-benzamide Openeye Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-3,4,5-triethoxy-benzamide CAS Name: N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-3,4,5-triethoxybenzamide IUPAC Name: N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-3,4,5-triethoxybenzamide Traditional Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-3,4,5-triethoxy-benzamide Formula: C26H25N5O4 MolecularWeight: 471.5078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C=C3)C#N

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C=C3)C#N

InChI

InChI=1S/C26H25N5O4/c1-4-33-21-13-18(14-22(34-5-2)24(21)35-6-3)26(32)30-25-19(15-27)16-28-31(25)23-12-11-17-9-7-8-10-20(17)29-23/h7-14,16H,4-6H2,1-3H3,(H,30,32)