N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine

Systemtic Name: N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine Openeye Name: N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine CAS Name: N-[[5-[(methylthio)methyl]-2-furanyl]methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine IUPAC Name: N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine Traditional Name: [5-[(methylthio)methyl]-2-furyl]methyl-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]amine Formula: C12H18N4OS MolecularWeight: 266.36252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=CN1C)NCC2=CC=C(O2)CSC

Isomeric SMILES

CC(C1=NN=CN1C)NCC2=CC=C(O2)CSC

InChI

InChI=1S/C12H18N4OS/c1-9(12-15-14-8-16(12)2)13-6-10-4-5-11(17-10)7-18-3/h4-5,8-9,13H,6-7H2,1-3H3