N-methyl-N-[[4-methyl-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1-thiophen-2-yl-methanamine

Systemtic Name: N-methyl-N-[[4-methyl-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1-thiophen-2-yl-methanamine Openeye Name: N-methyl-N-[[4-methyl-5-(4-pyridylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1-(2-thienyl)methanamine CAS Name: N-methyl-N-[[4-methyl-5-(pyridin-4-ylmethylthio)-1,2,4-triazol-3-yl]methyl]-1-thiophen-2-ylmethanamine IUPAC Name: N-methyl-N-[[4-methyl-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1-thiophen-2-ylmethanamine Traditional Name: methyl-[[4-methyl-5-(4-pyridylmethylthio)-1,2,4-triazol-3-yl]methyl]-(2-thenyl)amine Formula: C16H19N5S2 MolecularWeight: 345.48556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=NC=C2)CN(C)CC3=CC=CS3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=NC=C2)CN(C)CC3=CC=CS3

InChI

InChI=1S/C16H19N5S2/c1-20(10-14-4-3-9-22-14)11-15-18-19-16(21(15)2)23-12-13-5-7-17-8-6-13/h3-9H,10-12H2,1-2H3