4-[[4-(1H-benzimidazol-2-ylsulfanyl)-5-phenyl-thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium

Systemtic Name: 4-[[4-(1H-benzimidazol-2-ylsulfanyl)-5-phenyl-thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Openeye Name: 4-[[4-(1H-benzimidazol-2-ylsulfanyl)-5-phenyl-thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium CAS Name: 4-[[4-(1H-benzimidazol-2-ylthio)-5-phenyl-2-thieno[2,3-d]pyrimidinyl]methyl]morpholin-4-ium IUPAC Name: 4-[[4-(1H-benzimidazol-2-ylsulfanyl)-5-phenylthieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Traditional Name: 4-[[4-(1H-benzimidazol-2-ylthio)-5-phenyl-thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Formula: C24H22N5OS2+ MolecularWeight: 460.59438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=N2)SC5=NC6=CC=CC=C6N5

Isomeric SMILES

C1COCC[NH+]1CC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=N2)SC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C24H21N5OS2/c1-2-6-16(7-3-1)17-15-31-22-21(17)23(28-20(27-22)14-29-10-12-30-13-11-29)32-24-25-18-8-4-5-9-19(18)26-24/h1-9,15H,10-14H2,(H,25,26)/p+1