N-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-2-methyl-1,2,4-triazol-3-amine

Systemtic Name: N-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-2-methyl-1,2,4-triazol-3-amine Openeye Name: N-[2-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]ethyl]-2-methyl-1,2,4-triazol-3-amine CAS Name: N-[2-[[5-(dimethylaminomethyl)-2-furanyl]methylthio]ethyl]-2-methyl-1,2,4-triazol-3-amine IUPAC Name: N-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-2-methyl-1,2,4-triazol-3-amine Traditional Name: dimethyl-[[5-[[2-[(2-methyl-1,2,4-triazol-3-yl)amino]ethylthio]methyl]-2-furyl]methyl]amine Formula: C13H21N5OS MolecularWeight: 295.40374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC=N1)NCCSCC2=CC=C(O2)CN(C)C

Isomeric SMILES

CN1C(=NC=N1)NCCSCC2=CC=C(O2)CN(C)C

InChI

InChI=1S/C13H21N5OS/c1-17(2)8-11-4-5-12(19-11)9-20-7-6-14-13-15-10-16-18(13)3/h4-5,10H,6-9H2,1-3H3,(H,14,15,16)