4-chloranyl-2,6-bis(2-hydroxyethylamino)pyrimidine-5-carbonitrile

Systemtic Name: 4-chloranyl-2,6-bis(2-hydroxyethylamino)pyrimidine-5-carbonitrile Openeye Name: 4-chloro-2,6-bis(2-hydroxyethylamino)pyrimidine-5-carbonitrile CAS Name: 4-chloro-2,6-bis(2-hydroxyethylamino)-5-pyrimidinecarbonitrile IUPAC Name: 4-chloro-2,6-bis(2-hydroxyethylamino)pyrimidine-5-carbonitrile Traditional Name: 4-chloro-2,6-bis(2-hydroxyethylamino)pyrimidine-5-carbonitrile Formula: C9H12ClN5O2 MolecularWeight: 257.67688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CO)NC1=C(C(=NC(=N1)NCCO)Cl)C#N

Isomeric SMILES

C(CO)NC1=C(C(=NC(=N1)NCCO)Cl)C#N

InChI

InChI=1S/C9H12ClN5O2/c10-7-6(5-11)8(12-1-3-16)15-9(14-7)13-2-4-17/h16-17H,1-4H2,(H2,12,13,14,15)