2-tert-butyl-7-phenylsulfanyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 2-tert-butyl-7-phenylsulfanyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 2-tert-butyl-7-phenylsulfanyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine CAS Name: 2-tert-butyl-7-(phenylthio)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 2-tert-butyl-7-phenylsulfanyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Traditional Name: 2-tert-butyl-7-(phenylthio)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Formula: C17H16F3N3S MolecularWeight: 351.38925

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN2C(=C1)N=C(C=C2SC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=NN2C(=C1)N=C(C=C2SC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C17H16F3N3S/c1-16(2,3)12-9-14-21-13(17(18,19)20)10-15(23(14)22-12)24-11-7-5-4-6-8-11/h4-10H,1-3H3