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

Systemtic Name: N-methyl-N-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1-thiophen-3-yl-methanamine Openeye Name: N-methyl-N-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1-(3-thienyl)methanamine CAS Name: N-methyl-N-[[4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]methyl]-1-(3-thiophenyl)methanamine IUPAC Name: N-methyl-N-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1-thiophen-3-ylmethanamine Traditional Name: methyl-[[4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]methyl]-(3-thenyl)amine Formula: C18H22N4OS2 MolecularWeight: 374.52348

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC2=CC=CC=C2)CN(C)CC3=CSC=C3

Isomeric SMILES

CN1C(=NN=C1SCCOC2=CC=CC=C2)CN(C)CC3=CSC=C3

InChI

InChI=1S/C18H22N4OS2/c1-21(12-15-8-10-24-14-15)13-17-19-20-18(22(17)2)25-11-9-23-16-6-4-3-5-7-16/h3-8,10,14H,9,11-13H2,1-2H3