7-azanyl-6-cyano-5-(4-methylphenyl)-2-methylsulfanyl-N-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: 7-azanyl-6-cyano-5-(4-methylphenyl)-2-methylsulfanyl-N-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: 7-amino-6-cyano-2-methylsulfanyl-N-phenyl-5-(p-tolyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: 7-amino-6-cyano-5-(4-methylphenyl)-2-(methylthio)-N-phenyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 7-amino-6-cyano-5-(4-methylphenyl)-2-methylsulfanyl-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: 7-amino-6-cyano-2-(methylthio)-N-phenyl-5-(p-tolyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C22H18N6OS MolecularWeight: 414.48292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C(=NN3C(=C2C#N)N)SC)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C(=NN3C(=C2C#N)N)SC)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H18N6OS/c1-13-8-10-14(11-9-13)18-16(12-23)19(24)28-20(26-18)17(22(27-28)30-2)21(29)25-15-6-4-3-5-7-15/h3-11H,24H2,1-2H3,(H,25,29)