cyclopropyl-[(4-methoxyphenyl)methyl]-[(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Traditional Name: cyclopropyl-[[4-keto-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-p-anisyl-ammonium Formula: C22H22N3O2S2+ MolecularWeight: 424.55898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)C5CC5

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)C5CC5

InChI

InChI=1S/C22H21N3O2S2/c1-27-16-8-4-14(5-9-16)11-25(15-6-7-15)12-19-23-21(26)20-17(13-29-22(20)24-19)18-3-2-10-28-18/h2-5,8-10,13,15H,6-7,11-12H2,1H3,(H,23,24,26)/p+1