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

Systemtic Name: 2,5-dimethyl-3-phenyl-7-(phenylmethylsulfanyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 7-benzylsulfanyl-2,5-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 2,5-dimethyl-3-phenyl-7-(phenylmethylthio)pyrazolo[1,5-a]pyrimidine IUPAC Name: 7-benzylsulfanyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(benzylthio)-2,5-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C21H19N3S MolecularWeight: 345.46066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)SCC3=CC=CC=C3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)SCC3=CC=CC=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3S/c1-15-13-19(25-14-17-9-5-3-6-10-17)24-21(22-15)20(16(2)23-24)18-11-7-4-8-12-18/h3-13H,14H2,1-2H3