N4-but-2-ynyl-6-chloranyl-pyrimidine-4,5-diamine

Systemtic Name: N4-but-2-ynyl-6-chloranyl-pyrimidine-4,5-diamine Openeye Name: N4-but-2-ynyl-6-chloro-pyrimidine-4,5-diamine CAS Name: N4-but-2-ynyl-6-chloropyrimidine-4,5-diamine IUPAC Name: 4-N-but-2-ynyl-6-chloropyrimidine-4,5-diamine Traditional Name: (5-amino-6-chloro-pyrimidin-4-yl)-but-2-ynyl-amine Formula: C8H9ClN4 MolecularWeight: 196.63686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CCNC1=C(C(=NC=N1)Cl)N

Isomeric SMILES

CC#CCNC1=C(C(=NC=N1)Cl)N

InChI

InChI=1S/C8H9ClN4/c1-2-3-4-11-8-6(10)7(9)12-5-13-8/h5H,4,10H2,1H3,(H,11,12,13)