5-azanyl-3-[(Z)-1-cyano-2-(2-morpholin-4-ylquinolin-3-yl)ethenyl]-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[(Z)-1-cyano-2-(2-morpholin-4-ylquinolin-3-yl)ethenyl]-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-1-cyano-2-(2-morpholino-3-quinolyl)vinyl]-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-1-cyano-2-[2-(4-morpholinyl)-3-quinolinyl]ethenyl]-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-1-cyano-2-(2-morpholin-4-ylquinolin-3-yl)ethenyl]-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-1-cyano-2-(2-morpholino-3-quinolyl)vinyl]-1-phenyl-pyrazole-4-carbonitrile Formula: C26H21N7O MolecularWeight: 447.49124

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=CC=CC=C3C=C2C=C(C#N)C4=NN(C(=C4C#N)N)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1C2=NC3=CC=CC=C3C=C2/C=C(\C#N)/C4=NN(C(=C4C#N)N)C5=CC=CC=C5

InChI

InChI=1S/C26H21N7O/c27-16-20(24-22(17-28)25(29)33(31-24)21-7-2-1-3-8-21)15-19-14-18-6-4-5-9-23(18)30-26(19)32-10-12-34-13-11-32/h1-9,14-15H,10-13,29H2/b20-15+