2-[[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(4-thiazol-2-ylpiperazin-1-ium-1-yl)methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[4-(2-thiazolyl)-1-piperazin-1-iumyl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(4-thiazol-2-ylpiperazin-1-ium-1-yl)methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C14H16N5OS2+ MolecularWeight: 334.43974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=O)C3=C(N2)C=CS3)C4=NC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=O)C3=C(N2)C=CS3)C4=NC=CS4

InChI

InChI=1S/C14H15N5OS2/c20-13-12-10(1-7-21-12)16-11(17-13)9-18-3-5-19(6-4-18)14-15-2-8-22-14/h1-2,7-8H,3-6,9H2,(H,16,17,20)/p+1