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

Systemtic Name: N,5-dimethyl-N-(2-methylpropyl)-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-isobutyl-N,5-dimethyl-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N,5-dimethyl-N-(2-methylpropyl)-4-[3-(4-morpholin-4-iumyl)propylamino]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N,5-dimethyl-N-(2-methylpropyl)-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-isobutyl-N,5-dimethyl-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H32N5O2S+ MolecularWeight: 406.56538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N5O2S/c1-14(2)12-24(4)20(26)17-15(3)16-18(22-13-23-19(16)28-17)21-6-5-7-25-8-10-27-11-9-25/h13-14H,5-12H2,1-4H3,(H,21,22,23)/p+1