[2-(azepan-1-yl)-6-thiophen-2-yl-pyrimidin-4-yl]methylazanium

Systemtic Name: [2-(azepan-1-yl)-6-thiophen-2-yl-pyrimidin-4-yl]methylazanium Openeye Name: [2-(azepan-1-yl)-6-(2-thienyl)pyrimidin-4-yl]methylammonium CAS Name: [2-(1-azepanyl)-6-thiophen-2-yl-4-pyrimidinyl]methylammonium IUPAC Name: [2-(azepan-1-yl)-6-thiophen-2-ylpyrimidin-4-yl]methylazanium Traditional Name: [2-(azepan-1-yl)-6-(2-thienyl)pyrimidin-4-yl]methylammonium Formula: C15H21N4S+ MolecularWeight: 289.41904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=CC(=N2)C[NH3+])C3=CC=CS3

Isomeric SMILES

C1CCCN(CC1)C2=NC(=CC(=N2)C[NH3+])C3=CC=CS3

InChI

InChI=1S/C15H20N4S/c16-11-12-10-13(14-6-5-9-20-14)18-15(17-12)19-7-3-1-2-4-8-19/h5-6,9-10H,1-4,7-8,11,16H2/p+1