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

Systemtic Name: (3-methoxyphenyl)methyl-methyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Openeye Name: (3-methoxyphenyl)methyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium CAS Name: (3-methoxyphenyl)methyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: (3-methoxyphenyl)methyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Traditional Name: (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl-m-anisyl-methyl-ammonium Formula: C16H18N3O2S+ MolecularWeight: 316.39802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O2S/c1-19(9-11-4-3-5-12(8-11)21-2)10-14-17-13-6-7-22-15(13)16(20)18-14/h3-8H,9-10H2,1-2H3,(H,17,18,20)/p+1