(2R)-4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide

Systemtic Name: (2R)-4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide Openeye Name: (2R)-4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide CAS Name: (2R)-4-(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)-2-piperazin-1-iumcarboxamide IUPAC Name: (2R)-4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide Traditional Name: (2R)-4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide Formula: C13H18N5OS+ MolecularWeight: 292.37992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CC[NH2+]C(C3)C(=O)N)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CC[NH2+][C@H](C3)C(=O)N)C

InChI

InChI=1S/C13H17N5OS/c1-7-8(2)20-13-10(7)12(16-6-17-13)18-4-3-15-9(5-18)11(14)19/h6,9,15H,3-5H2,1-2H3,(H2,14,19)/p+1/t9-/m1/s1