4-methyl-3-[(E)-2-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethenyl]-6-oxidanylidene-1H-pyridazine-5-carbonitrile

Systemtic Name: 4-methyl-3-[(E)-2-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethenyl]-6-oxidanylidene-1H-pyridazine-5-carbonitrile Openeye Name: 4-methyl-3-[(E)-2-(2-morpholino-4-phenyl-thiazol-5-yl)vinyl]-6-oxo-1H-pyridazine-5-carbonitrile CAS Name: 4-methyl-3-[(E)-2-[2-(4-morpholinyl)-4-phenyl-5-thiazolyl]ethenyl]-6-oxo-1H-pyridazine-5-carbonitrile IUPAC Name: 4-methyl-3-[(E)-2-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethenyl]-6-oxo-1H-pyridazine-5-carbonitrile Traditional Name: 6-keto-4-methyl-3-[(E)-2-(2-morpholino-4-phenyl-thiazol-5-yl)vinyl]-1H-pyridazine-5-carbonitrile Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C=CC2=C(N=C(S2)N3CCOCC3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C(=O)NN=C1/C=C/C2=C(N=C(S2)N3CCOCC3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H19N5O2S/c1-14-16(13-22)20(27)25-24-17(14)7-8-18-19(15-5-3-2-4-6-15)23-21(29-18)26-9-11-28-12-10-26/h2-8H,9-12H2,1H3,(H,25,27)/b8-7+