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

Systemtic Name: 5-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)-N-propan-2-yl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-isopropyl-5-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-methyl-4-[3-(4-morpholin-4-iumyl)propylamino]-N-propan-2-yl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 5-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)-N-propan-2-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-isopropyl-5-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C18H28N5O2S+ MolecularWeight: 378.51222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N5O2S/c1-12(2)22-17(24)15-13(3)14-16(20-11-21-18(14)26-15)19-5-4-6-23-7-9-25-10-8-23/h11-12H,4-10H2,1-3H3,(H,22,24)(H,19,20,21)/p+1