2-[4-(3-azanyl-1H-1,2,4-triazol-5-yl)-1,3-thiazol-2-yl]guanidine; hexane

Systemtic Name: 2-[4-(3-azanyl-1H-1,2,4-triazol-5-yl)-1,3-thiazol-2-yl]guanidine; hexane Openeye Name: 2-[4-(3-amino-1H-1,2,4-triazol-5-yl)thiazol-2-yl]guanidine; hexane CAS Name: 2-[4-(3-amino-1H-1,2,4-triazol-5-yl)-2-thiazolyl]guanidine; hexane IUPAC Name: 2-[4-(3-amino-1H-1,2,4-triazol-5-yl)-1,3-thiazol-2-yl]guanidine; hexane Traditional Name: 2-[4-(3-amino-1H-1,2,4-triazol-5-yl)thiazol-2-yl]guanidine; n-hexane Formula: C12H22N8S MolecularWeight: 310.42168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.C1=C(N=C(S1)N=C(N)N)C2=NC(=NN2)N

Isomeric SMILES

CCCCCC.C1=C(N=C(S1)N=C(N)N)C2=NC(=NN2)N

InChI

InChI=1S/C6H8N8S.C6H14/c7-4(8)12-6-10-2(1-15-6)3-11-5(9)14-13-3;1-3-5-6-4-2/h1H,(H4,7,8,10,12)(H3,9,11,13,14);3-6H2,1-2H3