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

Systemtic Name: N-cyclopropyl-2-[4-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C16H23N5O2S+2 MolecularWeight: 349.45112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CC[NH+](CC2)CC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CC[NH+](CC2)CC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C16H21N5O2S/c22-14(17-11-1-2-11)10-21-6-4-20(5-7-21)9-13-18-12-3-8-24-15(12)16(23)19-13/h3,8,11H,1-2,4-7,9-10H2,(H,17,22)(H,18,19,23)/p+2