N-ethyl-5-methyl-4-(2-piperidin-1-ium-1-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-ethyl-5-methyl-4-(2-piperidin-1-ium-1-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-ethyl-5-methyl-4-(2-piperidin-1-ium-1-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-ethyl-5-methyl-4-[2-(1-piperidin-1-iumyl)ethylamino]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-ethyl-5-methyl-4-(2-piperidin-1-ium-1-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-ethyl-5-methyl-4-(2-piperidin-1-ium-1-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C17H26N5OS+ MolecularWeight: 348.48624

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C(C2=C(N=CN=C2S1)NCC[NH+]3CCCCC3)C

Isomeric SMILES

CCNC(=O)C1=C(C2=C(N=CN=C2S1)NCC[NH+]3CCCCC3)C

InChI

InChI=1S/C17H25N5OS/c1-3-18-16(23)14-12(2)13-15(20-11-21-17(13)24-14)19-7-10-22-8-5-4-6-9-22/h11H,3-10H2,1-2H3,(H,18,23)(H,19,20,21)/p+1