3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide

Systemtic Name: 3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide Openeye Name: 3-(2-thienylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamidine CAS Name: 3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide IUPAC Name: 3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide Traditional Name: 3-(2-thenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine-1-carboxamidine Formula: C13H17N5S MolecularWeight: 275.37258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C2C(=C(NN2C(=N)N)CC3=CC=CS3)C1

Isomeric SMILES

C1CCN=C2C(=C(NN2C(=N)N)CC3=CC=CS3)C1

InChI

InChI=1S/C13H17N5S/c14-13(15)18-12-10(5-1-2-6-16-12)11(17-18)8-9-4-3-7-19-9/h3-4,7,17H,1-2,5-6,8H2,(H3,14,15)