N,N-dimethyl-3-[[5-[(4-methylphenyl)sulfanylmethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propan-1-amine

Systemtic Name: N,N-dimethyl-3-[[5-[(4-methylphenyl)sulfanylmethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propan-1-amine Openeye Name: N,N-dimethyl-3-[[4-phenyl-5-(p-tolylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-amine CAS Name: N,N-dimethyl-3-[[5-[[(4-methylphenyl)thio]methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-1-propanamine IUPAC Name: N,N-dimethyl-3-[[5-[(4-methylphenyl)sulfanylmethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propan-1-amine Traditional Name: dimethyl-[3-[[4-phenyl-5-[(p-tolylthio)methyl]-1,2,4-triazol-3-yl]thio]propyl]amine Formula: C21H26N4S2 MolecularWeight: 398.58794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=NN=C(N2C3=CC=CC=C3)SCCCN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=NN=C(N2C3=CC=CC=C3)SCCCN(C)C

InChI

InChI=1S/C21H26N4S2/c1-17-10-12-19(13-11-17)27-16-20-22-23-21(26-15-7-14-24(2)3)25(20)18-8-5-4-6-9-18/h4-6,8-13H,7,14-16H2,1-3H3