4-[4,5-dihydro-1,3-thiazol-2-yl(pyridin-3-ylmethyl)amino]benzenecarbonitrile

Systemtic Name: 4-[4,5-dihydro-1,3-thiazol-2-yl(pyridin-3-ylmethyl)amino]benzenecarbonitrile Openeye Name: 4-[4,5-dihydrothiazol-2-yl(3-pyridylmethyl)amino]benzonitrile CAS Name: 4-[4,5-dihydrothiazol-2-yl(3-pyridinylmethyl)amino]benzonitrile IUPAC Name: 4-[4,5-dihydro-1,3-thiazol-2-yl(pyridin-3-ylmethyl)amino]benzonitrile Traditional Name: 4-[3-pyridylmethyl(2-thiazolin-2-yl)amino]benzonitrile Formula: C16H14N4S MolecularWeight: 294.37416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=N1)N(CC2=CN=CC=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CSC(=N1)N(CC2=CN=CC=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H14N4S/c17-10-13-3-5-15(6-4-13)20(16-19-8-9-21-16)12-14-2-1-7-18-11-14/h1-7,11H,8-9,12H2