5-azanyl-1-[6-(4-chloranyl-3,5-dimethyl-phenoxy)-2-methylsulfanyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[6-(4-chloranyl-3,5-dimethyl-phenoxy)-2-methylsulfanyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-(4-chloro-3,5-dimethyl-phenoxy)-2-methylsulfanyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-(4-chloro-3,5-dimethylphenoxy)-2-(methylthio)-4-pyrimidinyl]-3-methyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-(4-chloro-3,5-dimethylphenoxy)-2-methylsulfanylpyrimidin-4-yl]-3-methylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-(4-chloro-3,5-dimethyl-phenoxy)-2-(methylthio)pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Formula: C18H17ClN6OS MolecularWeight: 400.88518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=NC(=NC(=C2)N3C(=C(C(=N3)C)C#N)N)SC

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=NC(=NC(=C2)N3C(=C(C(=N3)C)C#N)N)SC

InChI

InChI=1S/C18H17ClN6OS/c1-9-5-12(6-10(2)16(9)19)26-15-7-14(22-18(23-15)27-4)25-17(21)13(8-20)11(3)24-25/h5-7H,21H2,1-4H3