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

Systemtic Name: (2R)-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide Openeye Name: (2R)-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide CAS Name: (2R)-4-(5-phenyl-4-thieno[2,3-d]pyrimidinyl)-2-piperazin-1-iumcarboxamide IUPAC Name: (2R)-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide Traditional Name: (2R)-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide Formula: C17H18N5OS+ MolecularWeight: 340.42272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC([NH2+]1)C(=O)N)C2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

C1CN(C[C@@H]([NH2+]1)C(=O)N)C2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C17H17N5OS/c18-15(23)13-8-22(7-6-19-13)16-14-12(11-4-2-1-3-5-11)9-24-17(14)21-10-20-16/h1-5,9-10,13,19H,6-8H2,(H2,18,23)/p+1/t13-/m1/s1