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

Systemtic Name: (2R)-4-(5-phenyl-2-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide Openeye Name: (2R)-4-[5-phenyl-2-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-ium-2-carboxamide CAS Name: (2R)-4-(5-phenyl-2-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)-2-piperazin-1-iumcarboxamide IUPAC Name: (2R)-4-(5-phenyl-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-2-carboxamide Traditional Name: (2R)-4-[5-phenyl-2-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-ium-2-carboxamide Formula: C21H20N5OS2+ MolecularWeight: 422.5464

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC([NH2+]1)C(=O)N)C2=C3C(=CSC3=NC(=N2)C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1CN(C[C@@H]([NH2+]1)C(=O)N)C2=C3C(=CSC3=NC(=N2)C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C21H19N5OS2/c22-18(27)15-11-26(9-8-23-15)20-17-14(13-5-2-1-3-6-13)12-29-21(17)25-19(24-20)16-7-4-10-28-16/h1-7,10,12,15,23H,8-9,11H2,(H2,22,27)/p+1/t15-/m1/s1