2-[4-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-(2-methyl-6-phenyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazin-1-iumyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]-1-piperidino-ethanone Formula: C24H30N5OS+ MolecularWeight: 436.5929

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C=C(SC2=N1)C3=CC=CC=C3)N4CC[NH+](CC4)CC(=O)N5CCCCC5

Isomeric SMILES

CC1=NC(=C2C=C(SC2=N1)C3=CC=CC=C3)N4CC[NH+](CC4)CC(=O)N5CCCCC5

InChI

InChI=1S/C24H29N5OS/c1-18-25-23(20-16-21(31-24(20)26-18)19-8-4-2-5-9-19)29-14-12-27(13-15-29)17-22(30)28-10-6-3-7-11-28/h2,4-5,8-9,16H,3,6-7,10-15,17H2,1H3/p+1