4-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methylsulfanyl]-7H-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 4-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methylsulfanyl]-7H-pyrazolo[1,5-a]pyrimidine Openeye Name: 4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methylsulfanyl]-7H-pyrazolo[1,5-a]pyrimidine CAS Name: 4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methylthio]-7H-pyrazolo[1,5-a]pyrimidine IUPAC Name: 4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methylsulfanyl]-7H-pyrazolo[1,5-a]pyrimidine Traditional Name: 4-[[4-[2-(2H-tetrazol-5-yl)phenyl]benzyl]thio]-7H-pyrazolo[1,5-a]pyrimidine Formula: C20H17N7S MolecularWeight: 387.46088

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CN(C2=CC=NN21)SCC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5

Isomeric SMILES

C1C=CN(C2=CC=NN21)SCC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5

InChI

InChI=1S/C20H17N7S/c1-2-5-18(20-22-24-25-23-20)17(4-1)16-8-6-15(7-9-16)14-28-27-13-3-12-26-19(27)10-11-21-26/h1-11,13H,12,14H2,(H,22,23,24,25)