5-methyl-7-pentylsulfanyl-3-phenyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-methyl-7-pentylsulfanyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 5-methyl-7-pentylsulfanyl-3-phenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 5-methyl-7-(pentylthio)-3-phenylpyrazolo[1,5-a]pyrimidine IUPAC Name: 5-methyl-7-pentylsulfanyl-3-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(amylthio)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C18H21N3S MolecularWeight: 311.44444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=CC(=NC2=C(C=NN12)C3=CC=CC=C3)C

Isomeric SMILES

CCCCCSC1=CC(=NC2=C(C=NN12)C3=CC=CC=C3)C

InChI

InChI=1S/C18H21N3S/c1-3-4-8-11-22-17-12-14(2)20-18-16(13-19-21(17)18)15-9-6-5-7-10-15/h5-7,9-10,12-13H,3-4,8,11H2,1-2H3