4-[(E)-3-[4-(1,3-thiazol-4-ylmethoxy)phenyl]prop-2-enoyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-[4-(1,3-thiazol-4-ylmethoxy)phenyl]prop-2-enoyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-[4-(thiazol-4-ylmethoxy)phenyl]prop-2-enoyl]benzonitrile CAS Name: 4-[(E)-1-oxo-3-[4-(4-thiazolylmethoxy)phenyl]prop-2-enyl]benzonitrile IUPAC Name: 4-[(E)-3-[4-(1,3-thiazol-4-ylmethoxy)phenyl]prop-2-enoyl]benzonitrile Traditional Name: 4-[(E)-3-[4-(thiazol-4-ylmethoxy)phenyl]acryloyl]benzonitrile Formula: C20H14N2O2S MolecularWeight: 346.40236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=CC=C(C=C2)C#N)OCC3=CSC=N3

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)C2=CC=C(C=C2)C#N)OCC3=CSC=N3

InChI

InChI=1S/C20H14N2O2S/c21-11-16-1-6-17(7-2-16)20(23)10-5-15-3-8-19(9-4-15)24-12-18-13-25-14-22-18/h1-10,13-14H,12H2/b10-5+