N-(3-methoxypropyl)-5-methyl-4-(2-morpholin-4-ium-4-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(3-methoxypropyl)-5-methyl-4-(2-morpholin-4-ium-4-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(3-methoxypropyl)-5-methyl-4-(2-morpholin-4-ium-4-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-methoxypropyl)-5-methyl-4-[2-(4-morpholin-4-iumyl)ethylamino]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3-methoxypropyl)-5-methyl-4-(2-morpholin-4-ium-4-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(3-methoxypropyl)-5-methyl-4-(2-morpholin-4-ium-4-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C18H28N5O3S+ MolecularWeight: 394.51162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC[NH+]3CCOCC3)C(=O)NCCCOC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC[NH+]3CCOCC3)C(=O)NCCCOC

InChI

InChI=1S/C18H27N5O3S/c1-13-14-16(19-5-6-23-7-10-26-11-8-23)21-12-22-18(14)27-15(13)17(24)20-4-3-9-25-2/h12H,3-11H2,1-2H3,(H,20,24)(H,19,21,22)/p+1