3,6-bis(azanyl)-5-cyano-N-propan-2-yl-thieno[2,3-b]pyridin-7-ium-2-carboxamide

Systemtic Name: 3,6-bis(azanyl)-5-cyano-N-propan-2-yl-thieno[2,3-b]pyridin-7-ium-2-carboxamide Openeye Name: 3,6-diamino-5-cyano-N-isopropyl-thieno[2,3-b]pyridin-7-ium-2-carboxamide CAS Name: 3,6-diamino-5-cyano-N-propan-2-yl-2-thieno[2,3-b]pyridin-7-iumcarboxamide IUPAC Name: 3,6-diamino-5-cyano-N-propan-2-ylthieno[2,3-b]pyridin-7-ium-2-carboxamide Traditional Name: 3,6-diamino-5-cyano-N-isopropyl-thieno[2,3-b]pyridin-7-ium-2-carboxamide Formula: C12H14N5OS+ MolecularWeight: 276.33746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C(C2=C(S1)[NH+]=C(C(=C2)C#N)N)N

Isomeric SMILES

CC(C)NC(=O)C1=C(C2=C(S1)[NH+]=C(C(=C2)C#N)N)N

InChI

InChI=1S/C12H13N5OS/c1-5(2)16-11(18)9-8(14)7-3-6(4-13)10(15)17-12(7)19-9/h3,5H,14H2,1-2H3,(H2,15,17)(H,16,18)/p+1