5-azanyl-3-ethyl-1-[6-(3-methyl-5-propan-2-yl-phenoxy)-2-methylsulfanyl-pyrimidin-4-yl]pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-ethyl-1-[6-(3-methyl-5-propan-2-yl-phenoxy)-2-methylsulfanyl-pyrimidin-4-yl]pyrazole-4-carbonitrile Openeye Name: 5-amino-3-ethyl-1-[6-(3-isopropyl-5-methyl-phenoxy)-2-methylsulfanyl-pyrimidin-4-yl]pyrazole-4-carbonitrile CAS Name: 5-amino-3-ethyl-1-[6-(3-methyl-5-propan-2-ylphenoxy)-2-(methylthio)-4-pyrimidinyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-ethyl-1-[6-(3-methyl-5-propan-2-ylphenoxy)-2-methylsulfanylpyrimidin-4-yl]pyrazole-4-carbonitrile Traditional Name: 5-amino-3-ethyl-1-[6-(3-isopropyl-5-methyl-phenoxy)-2-(methylthio)pyrimidin-4-yl]pyrazole-4-carbonitrile Formula: C21H24N6OS MolecularWeight: 408.51986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)SC)OC3=CC(=CC(=C3)C(C)C)C

Isomeric SMILES

CCC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)SC)OC3=CC(=CC(=C3)C(C)C)C

InChI

InChI=1S/C21H24N6OS/c1-6-17-16(11-22)20(23)27(26-17)18-10-19(25-21(24-18)29-5)28-15-8-13(4)7-14(9-15)12(2)3/h7-10,12H,6,23H2,1-5H3