N,N-dimethyl-3-[4-[5-(2-phenoxyethylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]phenoxy]propan-1-amine

Systemtic Name: N,N-dimethyl-3-[4-[5-(2-phenoxyethylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]phenoxy]propan-1-amine Openeye Name: N,N-dimethyl-3-[4-[5-(2-phenoxyethylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]phenoxy]propan-1-amine CAS Name: N,N-dimethyl-3-[4-[5-[(2-phenoxyethylthio)methyl]-4-phenyl-1,2,4-triazol-3-yl]phenoxy]-1-propanamine IUPAC Name: N,N-dimethyl-3-[4-[5-(2-phenoxyethylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]phenoxy]propan-1-amine Traditional Name: dimethyl-[3-[4-[5-[(2-phenoxyethylthio)methyl]-4-phenyl-1,2,4-triazol-3-yl]phenoxy]propyl]amine Formula: C28H32N4O2S MolecularWeight: 488.64428

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)CSCCOC4=CC=CC=C4

Isomeric SMILES

CN(C)CCCOC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)CSCCOC4=CC=CC=C4

InChI

InChI=1S/C28H32N4O2S/c1-31(2)18-9-19-33-26-16-14-23(15-17-26)28-30-29-27(32(28)24-10-5-3-6-11-24)22-35-21-20-34-25-12-7-4-8-13-25/h3-8,10-17H,9,18-22H2,1-2H3