3-[1-(thiophen-2-ylmethyl)azepan-4-yl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[1-(thiophen-2-ylmethyl)azepan-4-yl]-1,2,4-triazol-4-amine Openeye Name: 3-[1-(2-thienylmethyl)azepan-4-yl]-1,2,4-triazol-4-amine CAS Name: 3-[1-(thiophen-2-ylmethyl)-4-azepanyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[1-(thiophen-2-ylmethyl)azepan-4-yl]-1,2,4-triazol-4-amine Traditional Name: [3-[1-(2-thenyl)azepan-4-yl]-1,2,4-triazol-4-yl]amine Formula: C13H19N5S MolecularWeight: 277.38846

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)CC2=CC=CS2)C3=NN=CN3N

Isomeric SMILES

C1CC(CCN(C1)CC2=CC=CS2)C3=NN=CN3N

InChI

InChI=1S/C13H19N5S/c14-18-10-15-16-13(18)11-3-1-6-17(7-5-11)9-12-4-2-8-19-12/h2,4,8,10-11H,1,3,5-7,9,14H2