5-azanyl-1-[6-(2,5-dimethylphenoxy)pyrimidin-4-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[6-(2,5-dimethylphenoxy)pyrimidin-4-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-(2,5-dimethylphenoxy)pyrimidin-4-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-(2,5-dimethylphenoxy)-4-pyrimidinyl]-3-(methylthio)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-(2,5-dimethylphenoxy)pyrimidin-4-yl]-3-methylsulfanylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-(2,5-dimethylphenoxy)pyrimidin-4-yl]-3-(methylthio)pyrazole-4-carbonitrile Formula: C17H16N6OS MolecularWeight: 352.41354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=NC=NC(=C2)N3C(=C(C(=N3)SC)C#N)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=NC=NC(=C2)N3C(=C(C(=N3)SC)C#N)N

InChI

InChI=1S/C17H16N6OS/c1-10-4-5-11(2)13(6-10)24-15-7-14(20-9-21-15)23-16(19)12(8-18)17(22-23)25-3/h4-7,9H,19H2,1-3H3