1-[[5-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]piperidine

Systemtic Name: 1-[[5-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]piperidine Openeye Name: 1-[[5-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]piperidine CAS Name: 1-[[5-[[4-(methylthio)phenyl]methylthio]-4-phenyl-1,2,4-triazol-3-yl]methyl]piperidine IUPAC Name: 1-[[5-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]piperidine Traditional Name: 1-[[5-[[4-(methylthio)benzyl]thio]-4-phenyl-1,2,4-triazol-3-yl]methyl]piperidine Formula: C22H26N4S2 MolecularWeight: 410.59864

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CN4CCCCC4

Isomeric SMILES

CSC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CN4CCCCC4

InChI

InChI=1S/C22H26N4S2/c1-27-20-12-10-18(11-13-20)17-28-22-24-23-21(16-25-14-6-3-7-15-25)26(22)19-8-4-2-5-9-19/h2,4-5,8-13H,3,6-7,14-17H2,1H3