1-[4-(phenylmethyl)-5-[(2-phenylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propan-1-amine

Systemtic Name: 1-[4-(phenylmethyl)-5-[(2-phenylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propan-1-amine Openeye Name: 1-[4-benzyl-5-[(2-phenylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propan-1-amine CAS Name: 1-[4-(phenylmethyl)-5-[(2-phenylphenyl)methylthio]-1,2,4-triazol-3-yl]-1-propanamine IUPAC Name: 1-[4-benzyl-5-[(2-phenylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propan-1-amine Traditional Name: 1-[4-benzyl-5-[(2-phenylbenzyl)thio]-1,2,4-triazol-3-yl]propylamine Formula: C25H26N4S MolecularWeight: 414.56574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=C(N1CC2=CC=CC=C2)SCC3=CC=CC=C3C4=CC=CC=C4)N

Isomeric SMILES

CCC(C1=NN=C(N1CC2=CC=CC=C2)SCC3=CC=CC=C3C4=CC=CC=C4)N

InChI

InChI=1S/C25H26N4S/c1-2-23(26)24-27-28-25(29(24)17-19-11-5-3-6-12-19)30-18-21-15-9-10-16-22(21)20-13-7-4-8-14-20/h3-16,23H,2,17-18,26H2,1H3