3-[2-(7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinolin-2-yl)-1,3-thiazol-5-yl]-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[2-(7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinolin-2-yl)-1,3-thiazol-5-yl]-5-fluoranyl-benzenecarbonitrile Openeye Name: 3-[2-(7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)thiazol-5-yl]-5-fluoro-benzonitrile CAS Name: 3-[2-(7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)-5-thiazolyl]-5-fluorobenzonitrile IUPAC Name: 3-[2-(7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)-1,3-thiazol-5-yl]-5-fluorobenzonitrile Traditional Name: 3-fluoro-5-[2-(5-keto-7,7-dimethyl-6,8-dihydroquinolin-2-yl)thiazol-5-yl]benzonitrile Formula: C21H16FN3OS MolecularWeight: 377.434643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=N2)C3=NC=C(S3)C4=CC(=CC(=C4)C#N)F)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=CC(=N2)C3=NC=C(S3)C4=CC(=CC(=C4)C#N)F)C(=O)C1)C

InChI

InChI=1S/C21H16FN3OS/c1-21(2)8-17-15(18(26)9-21)3-4-16(25-17)20-24-11-19(27-20)13-5-12(10-23)6-14(22)7-13/h3-7,11H,8-9H2,1-2H3