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

Systemtic Name: 5,7-dimethyl-N-[2-(phenylmethylsulfanyl)ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: 5,7-dimethyl-N-[2-(phenylmethylthio)ethyl]-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C18H20N4OS MolecularWeight: 340.4426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(C=NN12)C(=O)NCCSCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC2=C(C=NN12)C(=O)NCCSCC3=CC=CC=C3)C

InChI

InChI=1S/C18H20N4OS/c1-13-10-14(2)22-17(21-13)16(11-20-22)18(23)19-8-9-24-12-15-6-4-3-5-7-15/h3-7,10-11H,8-9,12H2,1-2H3,(H,19,23)