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

Systemtic Name: 5-azanyl-1-[6-(4-chloranylphenoxy)-2-methylsulfanyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-(4-chlorophenoxy)-2-methylsulfanyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-(4-chlorophenoxy)-2-(methylthio)-4-pyrimidinyl]-3-methyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-(4-chlorophenoxy)-2-methylsulfanylpyrimidin-4-yl]-3-methylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-(4-chlorophenoxy)-2-(methylthio)pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Formula: C16H13ClN6OS MolecularWeight: 372.83202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)SC)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)SC)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN6OS/c1-9-12(8-18)15(19)23(22-9)13-7-14(21-16(20-13)25-2)24-11-5-3-10(17)4-6-11/h3-7H,19H2,1-2H3