N-cyclopropyl-2-[4-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C22H27N5O2S+2 MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CC[NH+](CC2)CC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CC[NH+](CC2)CC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3

InChI

InChI=1S/C22H25N5O2S/c28-19(23-16-6-7-16)13-27-10-8-26(9-11-27)12-18-24-21(29)20-17(14-30-22(20)25-18)15-4-2-1-3-5-15/h1-5,14,16H,6-13H2,(H,23,28)(H,24,25,29)/p+2