1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide Openeye Name: 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide CAS Name: 1-(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide Traditional Name: 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]isonipecotamide Formula: C23H36N5OS+ MolecularWeight: 430.62984

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)C2CCN(CC2)C3=C4C(=C(SC4=NC=N3)C)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)C2CCN(CC2)C3=C4C(=C(SC4=NC=N3)C)C

InChI

InChI=1S/C23H35N5OS/c1-16-5-11-27(12-6-16)10-4-9-24-22(29)19-7-13-28(14-8-19)21-20-17(2)18(3)30-23(20)26-15-25-21/h15-16,19H,4-14H2,1-3H3,(H,24,29)/p+1