5,7-dimethyl-N-(2-phenylsulfanylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: 5,7-dimethyl-N-(2-phenylsulfanylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: 5,7-dimethyl-N-(2-phenylsulfanylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: 5,7-dimethyl-N-[2-(phenylthio)phenyl]-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 5,7-dimethyl-N-(2-phenylsulfanylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: 5,7-dimethyl-N-[2-(phenylthio)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(C=NN12)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC2=C(C=NN12)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C

InChI

InChI=1S/C21H18N4OS/c1-14-12-15(2)25-20(23-14)17(13-22-25)21(26)24-18-10-6-7-11-19(18)27-16-8-4-3-5-9-16/h3-13H,1-2H3,(H,24,26)