5-methyl-3-phenyl-7-prop-2-enylsulfanyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-methyl-3-phenyl-7-prop-2-enylsulfanyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 7-allylsulfanyl-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 5-methyl-3-phenyl-7-(prop-2-enylthio)pyrazolo[1,5-a]pyrimidine IUPAC Name: 5-methyl-3-phenyl-7-prop-2-enylsulfanylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(allylthio)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(=C1)SCC=C)C3=CC=CC=C3

Isomeric SMILES

CC1=NC2=C(C=NN2C(=C1)SCC=C)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3S/c1-3-9-20-15-10-12(2)18-16-14(11-17-19(15)16)13-7-5-4-6-8-13/h3-8,10-11H,1,9H2,2H3