1-(2-methoxyphenyl)-N-methyl-N-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]methanamine

Systemtic Name: 1-(2-methoxyphenyl)-N-methyl-N-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]methanamine Openeye Name: 1-(2-methoxyphenyl)-N-methyl-N-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]methanamine CAS Name: 1-(2-methoxyphenyl)-N-methyl-N-[[4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]methyl]methanamine IUPAC Name: 1-(2-methoxyphenyl)-N-methyl-N-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]methanamine Traditional Name: methyl-[[4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]methyl]-o-anisyl-amine Formula: C21H26N4O2S MolecularWeight: 398.52174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC2=CC=CC=C2)CN(C)CC3=CC=CC=C3OC

Isomeric SMILES

CN1C(=NN=C1SCCOC2=CC=CC=C2)CN(C)CC3=CC=CC=C3OC

InChI

InChI=1S/C21H26N4O2S/c1-24(15-17-9-7-8-12-19(17)26-3)16-20-22-23-21(25(20)2)28-14-13-27-18-10-5-4-6-11-18/h4-12H,13-16H2,1-3H3