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

Systemtic Name: 5-methyl-N-(2-methylpropyl)-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-isobutyl-5-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-methyl-N-(2-methylpropyl)-4-[3-(4-morpholin-4-iumyl)propylamino]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 5-methyl-N-(2-methylpropyl)-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-isobutyl-5-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C19H30N5O2S+ MolecularWeight: 392.5388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N5O2S/c1-13(2)11-21-18(25)16-14(3)15-17(22-12-23-19(15)27-16)20-5-4-6-24-7-9-26-10-8-24/h12-13H,4-11H2,1-3H3,(H,21,25)(H,20,22,23)/p+1