4-chloranyl-2-(1,1,2,2,2-pentadeuterioethyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-chloranyl-2-(1,1,2,2,2-pentadeuterioethyl)pyrimidine-5-carbonitrile Openeye Name: 4-chloro-2-(1,1,2,2,2-pentadeuterioethyl)pyrimidine-5-carbonitrile CAS Name: 4-chloro-2-(1,1,2,2,2-pentadeuterioethyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-chloro-2-(1,1,2,2,2-pentadeuterioethyl)pyrimidine-5-carbonitrile Traditional Name: 4-chloro-2-(1,1,2,2,2-pentadeuterioethyl)pyrimidine-5-carbonitrile Formula: C7H6ClN3 MolecularWeight: 172.626449

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C(=N1)Cl)C#N

Isomeric SMILES

[2H]C([2H])([2H])C([2H])([2H])C1=NC=C(C(=N1)Cl)C#N

InChI

InChI=1S/C7H6ClN3/c1-2-6-10-4-5(3-9)7(8)11-6/h4H,2H2,1H3/i1D3,2D2