2-[4-[(2-ethyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[4-[(2-ethyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[4-[(2-ethylthiazol-4-yl)methyl]piperazin-1-yl]-6-fluoro-benzonitrile CAS Name: 2-[4-[(2-ethyl-4-thiazolyl)methyl]-1-piperazinyl]-6-fluorobenzonitrile IUPAC Name: 2-[4-[(2-ethyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-6-fluorobenzonitrile Traditional Name: 2-[4-[(2-ethylthiazol-4-yl)methyl]piperazino]-6-fluoro-benzonitrile Formula: C17H19FN4S MolecularWeight: 330.422963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)CN2CCN(CC2)C3=C(C(=CC=C3)F)C#N

Isomeric SMILES

CCC1=NC(=CS1)CN2CCN(CC2)C3=C(C(=CC=C3)F)C#N

InChI

InChI=1S/C17H19FN4S/c1-2-17-20-13(12-23-17)11-21-6-8-22(9-7-21)16-5-3-4-15(18)14(16)10-19/h3-5,12H,2,6-9,11H2,1H3