2-[(5E)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]ethanenitrile

Systemtic Name: 2-[(5E)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]ethanenitrile Openeye Name: 2-[(5E)-5-[(1,3-diphenylpyrazol-4-yl)methylene]-4-oxo-thiazol-2-yl]acetonitrile CAS Name: 2-[(5E)-5-[(1,3-diphenyl-4-pyrazolyl)methylidene]-4-oxo-2-thiazolyl]acetonitrile IUPAC Name: 2-[(5E)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-4-oxo-1,3-thiazol-2-yl]acetonitrile Traditional Name: 2-[(5E)-5-[(1,3-diphenylpyrazol-4-yl)methylene]-4-keto-2-thiazolin-2-yl]acetonitrile Formula: C21H14N4OS MolecularWeight: 370.42706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)CC#N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=C/3\C(=O)N=C(S3)CC#N)C4=CC=CC=C4

InChI

InChI=1S/C21H14N4OS/c22-12-11-19-23-21(26)18(27-19)13-16-14-25(17-9-5-2-6-10-17)24-20(16)15-7-3-1-4-8-15/h1-10,13-14H,11H2/b18-13+