5-azanyl-1-(6-chloranyl-2-phenyl-pyrimidin-4-yl)-3-methylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(6-chloranyl-2-phenyl-pyrimidin-4-yl)-3-methylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(6-chloro-2-phenyl-pyrimidin-4-yl)-3-methylsulfanyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-(6-chloro-2-phenyl-4-pyrimidinyl)-3-(methylthio)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(6-chloro-2-phenylpyrimidin-4-yl)-3-methylsulfanylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-(6-chloro-2-phenyl-pyrimidin-4-yl)-3-(methylthio)pyrazole-4-carbonitrile Formula: C15H11ClN6S MolecularWeight: 342.80604

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)C3=CC=CC=C3)Cl

Isomeric SMILES

CSC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C15H11ClN6S/c1-23-15-10(8-17)13(18)22(21-15)12-7-11(16)19-14(20-12)9-5-3-2-4-6-9/h2-7H,18H2,1H3