(2,4-dimethylphenyl)methyl-methyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium

Systemtic Name: (2,4-dimethylphenyl)methyl-methyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Openeye Name: (2,4-dimethylphenyl)methyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium CAS Name: (2,4-dimethylphenyl)methyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: (2,4-dimethylphenyl)methyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Traditional Name: (2,4-dimethylbenzyl)-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-methyl-ammonium Formula: C17H20N3OS+ MolecularWeight: 314.4252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C[NH+](C)CC2=NC(=O)C3=C(N2)C=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C[NH+](C)CC2=NC(=O)C3=C(N2)C=CS3)C

InChI

InChI=1S/C17H19N3OS/c1-11-4-5-13(12(2)8-11)9-20(3)10-15-18-14-6-7-22-16(14)17(21)19-15/h4-8H,9-10H2,1-3H3,(H,18,19,21)/p+1