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

Systemtic Name: 2,5-dimethyl-3-phenyl-7-prop-2-enylsulfanyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 7-allylsulfanyl-2,5-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 2,5-dimethyl-3-phenyl-7-(prop-2-enylthio)pyrazolo[1,5-a]pyrimidine IUPAC Name: 2,5-dimethyl-3-phenyl-7-prop-2-enylsulfanylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(allylthio)-2,5-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3S/c1-4-10-21-15-11-12(2)18-17-16(13(3)19-20(15)17)14-8-6-5-7-9-14/h4-9,11H,1,10H2,2-3H3