2-[(2-azanyl-4-methylsulfanyl-6-pyridin-2-yl-pyrimidin-5-yl)amino]-4-(2,3-dihydrofuran-5-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-[(2-azanyl-4-methylsulfanyl-6-pyridin-2-yl-pyrimidin-5-yl)amino]-4-(2,3-dihydrofuran-5-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 2-[[2-amino-4-methylsulfanyl-6-(2-pyridyl)pyrimidin-5-yl]amino]-4-(2,3-dihydrofuran-5-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 2-[[2-amino-4-(methylthio)-6-(2-pyridinyl)-5-pyrimidinyl]amino]-4-(2,3-dihydrofuran-5-yl)-6-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 2-[(2-amino-4-methylsulfanyl-6-pyridin-2-ylpyrimidin-5-yl)amino]-4-(2,3-dihydrofuran-5-yl)-6-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 2-[[2-amino-4-(methylthio)-6-(2-pyridyl)pyrimidin-5-yl]amino]-4-(2,3-dihydrofuran-5-yl)-6-(methylthio)pyrimidine-5-carbonitrile Formula: C20H18N8OS2 MolecularWeight: 450.53992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)C2=CCCO2)NC3=C(N=C(N=C3SC)N)C4=CC=CC=N4

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)C2=CCCO2)NC3=C(N=C(N=C3SC)N)C4=CC=CC=N4

InChI

InChI=1S/C20H18N8OS2/c1-30-17-11(10-21)14(13-7-5-9-29-13)25-20(28-17)26-16-15(12-6-3-4-8-23-12)24-19(22)27-18(16)31-2/h3-4,6-8H,5,9H2,1-2H3,(H2,22,24,27)(H,25,26,28)