5-azanyl-1-(2-methylsulfanyl-6-phenoxy-pyrimidin-4-yl)pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(2-methylsulfanyl-6-phenoxy-pyrimidin-4-yl)pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(2-methylsulfanyl-6-phenoxy-pyrimidin-4-yl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-[2-(methylthio)-6-phenoxy-4-pyrimidinyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2-methylsulfanyl-6-phenoxypyrimidin-4-yl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-[2-(methylthio)-6-phenoxy-pyrimidin-4-yl]pyrazole-4-carbonitrile Formula: C15H12N6OS MolecularWeight: 324.36038

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)OC2=CC=CC=C2)N3C(=C(C=N3)C#N)N

Isomeric SMILES

CSC1=NC(=CC(=N1)OC2=CC=CC=C2)N3C(=C(C=N3)C#N)N

InChI

InChI=1S/C15H12N6OS/c1-23-15-19-12(21-14(17)10(8-16)9-18-21)7-13(20-15)22-11-5-3-2-4-6-11/h2-7,9H,17H2,1H3