7-butan-2-ylsulfanyl-2,5-dimethyl-3-phenyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 7-butan-2-ylsulfanyl-2,5-dimethyl-3-phenyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 6-benzyl-2,5-dimethyl-3-phenyl-7-sec-butylsulfanyl-pyrazolo[1,5-a]pyrimidine CAS Name: 7-(butan-2-ylthio)-2,5-dimethyl-3-phenyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 6-benzyl-7-butan-2-ylsulfanyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 6-benzyl-2,5-dimethyl-3-phenyl-7-(sec-butylthio)pyrazolo[1,5-a]pyrimidine Formula: C25H27N3S MolecularWeight: 401.56698

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=C(C(=NC2=C(C(=NN21)C)C3=CC=CC=C3)C)CC4=CC=CC=C4

Isomeric SMILES

CCC(C)SC1=C(C(=NC2=C(C(=NN21)C)C3=CC=CC=C3)C)CC4=CC=CC=C4

InChI

InChI=1S/C25H27N3S/c1-5-17(2)29-25-22(16-20-12-8-6-9-13-20)18(3)26-24-23(19(4)27-28(24)25)21-14-10-7-11-15-21/h6-15,17H,5,16H2,1-4H3