4-[(E)-2-[4-(1-adamantyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-2-[4-(1-adamantyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-[4-(1-adamantyl)thiazol-2-yl]-2-cyano-vinyl]benzonitrile CAS Name: 4-[(E)-2-[4-(1-adamantyl)-2-thiazolyl]-2-cyanoethenyl]benzonitrile IUPAC Name: 4-[(E)-2-[4-(1-adamantyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]benzonitrile Traditional Name: 4-[(E)-2-[4-(1-adamantyl)thiazol-2-yl]-2-cyano-vinyl]benzonitrile Formula: C23H21N3S MolecularWeight: 371.49794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)C(=CC5=CC=C(C=C5)C#N)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)/C(=C/C5=CC=C(C=C5)C#N)/C#N

InChI

InChI=1S/C23H21N3S/c24-12-16-3-1-15(2-4-16)8-20(13-25)22-26-21(14-27-22)23-9-17-5-18(10-23)7-19(6-17)11-23/h1-4,8,14,17-19H,5-7,9-11H2/b20-8+