N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolinyl)-3-pyrazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-cyano-2-(8-methoxy-4-methylquinolin-2-yl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]-piperonylamide Formula: C23H17N5O4 MolecularWeight: 427.41218

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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=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H17N5O4/c1-13-8-20(26-21-16(13)4-3-5-18(21)30-2)28-22(15(10-24)11-25-28)27-23(29)14-6-7-17-19(9-14)32-12-31-17/h3-9,11H,12H2,1-2H3,(H,27,29)