4-azanyl-2-[1-(3-butyl-1,2,4-oxadiazol-5-yl)ethylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[1-(3-butyl-1,2,4-oxadiazol-5-yl)ethylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[1-(3-butyl-1,2,4-oxadiazol-5-yl)ethylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[1-(3-butyl-1,2,4-oxadiazol-5-yl)ethylthio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[1-(3-butyl-1,2,4-oxadiazol-5-yl)ethylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[1-(3-butyl-1,2,4-oxadiazol-5-yl)ethylthio]pyrimidine-5-carbonitrile Formula: C13H16N6OS MolecularWeight: 304.37074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NOC(=N1)C(C)SC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CCCCC1=NOC(=N1)C(C)SC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C13H16N6OS/c1-3-4-5-10-17-12(20-19-10)8(2)21-13-16-7-9(6-14)11(15)18-13/h7-8H,3-5H2,1-2H3,(H2,15,16,18)