1-[4-[5-(dimethylaminomethyl)thiophen-2-yl]butyl]-1,2,4-triazole-3,5-diamine

Systemtic Name: 1-[4-[5-(dimethylaminomethyl)thiophen-2-yl]butyl]-1,2,4-triazole-3,5-diamine Openeye Name: 1-[4-[5-(dimethylaminomethyl)-2-thienyl]butyl]-1,2,4-triazole-3,5-diamine CAS Name: 1-[4-[5-(dimethylaminomethyl)-2-thiophenyl]butyl]-1,2,4-triazole-3,5-diamine IUPAC Name: 1-[4-[5-(dimethylaminomethyl)thiophen-2-yl]butyl]-1,2,4-triazole-3,5-diamine Traditional Name: [5-[4-(3,5-diamino-1,2,4-triazol-1-yl)butyl]-2-thienyl]methyl-dimethyl-amine Formula: C13H22N6S MolecularWeight: 294.41898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(S1)CCCCN2C(=NC(=N2)N)N

Isomeric SMILES

CN(C)CC1=CC=C(S1)CCCCN2C(=NC(=N2)N)N

InChI

InChI=1S/C13H22N6S/c1-18(2)9-11-7-6-10(20-11)5-3-4-8-19-13(15)16-12(14)17-19/h6-7H,3-5,8-9H2,1-2H3,(H4,14,15,16,17)