N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]-4-(2-methylpropoxy)benzamide

Systemtic Name: N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]-4-(2-methylpropoxy)benzamide Openeye Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]-4-isobutoxy-benzamide CAS Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolinyl)-3-pyrazolyl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[4-cyano-2-(8-methoxy-4-methylquinolin-2-yl)pyrazol-3-yl]-4-(2-methylpropoxy)benzamide Traditional Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]-4-isobutoxy-benzamide Formula: C26H25N5O3 MolecularWeight: 455.5084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C4=CC=C(C=C4)OCC(C)C

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C4=CC=C(C=C4)OCC(C)C

InChI

InChI=1S/C26H25N5O3/c1-16(2)15-34-20-10-8-18(9-11-20)26(32)30-25-19(13-27)14-28-31(25)23-12-17(3)21-6-5-7-22(33-4)24(21)29-23/h5-12,14,16H,15H2,1-4H3,(H,30,32)