2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2,5-dimethyl-4-(4-methyl-1-piperazin-4-iumyl)-N-[3-(4-morpholin-4-iumyl)propyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H34N6O2S+2 MolecularWeight: 434.59866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CC[NH+](CC3)C)C)C(=O)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CC[NH+](CC3)C)C)C(=O)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C21H32N6O2S/c1-15-17-19(27-9-7-25(3)8-10-27)23-16(2)24-21(17)30-18(15)20(28)22-5-4-6-26-11-13-29-14-12-26/h4-14H2,1-3H3,(H,22,28)/p+2