3-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole Openeye Name: 3-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole CAS Name: 3-[[4-(methylthio)phenyl]methylthio]-4-phenyl-5-(1-pyrrolidinylmethyl)-1,2,4-triazole IUPAC Name: 3-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole Traditional Name: 3-[[4-(methylthio)benzyl]thio]-4-phenyl-5-(pyrrolidinomethyl)-1,2,4-triazole Formula: C21H24N4S2 MolecularWeight: 396.57206

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CN4CCCC4

Isomeric SMILES

CSC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CN4CCCC4

InChI

InChI=1S/C21H24N4S2/c1-26-19-11-9-17(10-12-19)16-27-21-23-22-20(15-24-13-5-6-14-24)25(21)18-7-3-2-4-8-18/h2-4,7-12H,5-6,13-16H2,1H3