[6-(4-methoxyphenyl)-4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [6-(4-methoxyphenyl)-4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[6-(4-methoxyphenyl)-4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl]methyl]-methyl-ammonium CAS Name: [6-(4-methoxyphenyl)-4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[6-(4-methoxyphenyl)-4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl]methyl]-methylazanium Traditional Name: benzyl-[[4-keto-6-(4-methoxyphenyl)-1H-thieno[3,2-d]pyrimidin-2-yl]methyl]-methyl-ammonium Formula: C22H22N3O2S+ MolecularWeight: 392.49398

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=NC(=O)C3=C(N2)C=C(S3)C4=CC=C(C=C4)OC

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=NC(=O)C3=C(N2)C=C(S3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H21N3O2S/c1-25(13-15-6-4-3-5-7-15)14-20-23-18-12-19(28-21(18)22(26)24-20)16-8-10-17(27-2)11-9-16/h3-12H,13-14H2,1-2H3,(H,23,24,26)/p+1