5-tert-butyl-2-methyl-3-phenyl-7-(phenylmethylsulfanyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-tert-butyl-2-methyl-3-phenyl-7-(phenylmethylsulfanyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 7-benzylsulfanyl-5-tert-butyl-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 5-tert-butyl-2-methyl-3-phenyl-7-(phenylmethylthio)pyrazolo[1,5-a]pyrimidine IUPAC Name: 7-benzylsulfanyl-5-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(benzylthio)-5-tert-butyl-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C24H25N3S MolecularWeight: 387.5404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C(C)(C)C)SCC4=CC=CC=C4

Isomeric SMILES

CC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C(C)(C)C)SCC4=CC=CC=C4

InChI

InChI=1S/C24H25N3S/c1-17-22(19-13-9-6-10-14-19)23-25-20(24(2,3)4)15-21(27(23)26-17)28-16-18-11-7-5-8-12-18/h5-15H,16H2,1-4H3