N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-piperonylamide Formula: C21H13N5O3 MolecularWeight: 383.35962

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=C(C=NN3C4=NC5=CC=CC=C5C=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=C(C=NN3C4=NC5=CC=CC=C5C=C4)C#N

InChI

InChI=1S/C21H13N5O3/c22-10-15-11-23-26(19-8-6-13-3-1-2-4-16(13)24-19)20(15)25-21(27)14-5-7-17-18(9-14)29-12-28-17/h1-9,11H,12H2,(H,25,27)