(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-hexyl-azanium

Systemtic Name: (5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-hexyl-azanium Openeye Name: (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-hexyl-ammonium CAS Name: (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-hexylammonium IUPAC Name: (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-hexylazanium Traditional Name: hexyl-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium Formula: C15H24N3OS+ MolecularWeight: 294.43556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]CC1=NC2=C(C(=C(S2)C)C)C(=O)N1

Isomeric SMILES

CCCCCC[NH2+]CC1=NC2=C(C(=C(S2)C)C)C(=O)N1

InChI

InChI=1S/C15H23N3OS/c1-4-5-6-7-8-16-9-12-17-14(19)13-10(2)11(3)20-15(13)18-12/h16H,4-9H2,1-3H3,(H,17,18,19)/p+1