1-[[5-[[(2E)-2-(nitrosomethylidene)pyridin-1-yl]methyl]thiophen-2-yl]methyl]pyridin-1-ium-4-carboxamide

Systemtic Name: 1-[[5-[[(2E)-2-(nitrosomethylidene)pyridin-1-yl]methyl]thiophen-2-yl]methyl]pyridin-1-ium-4-carboxamide Openeye Name: 1-[[5-[[(2E)-2-(nitrosomethylene)-1-pyridyl]methyl]-2-thienyl]methyl]pyridin-1-ium-4-carboxamide CAS Name: 1-[[5-[[(2E)-2-(nitrosomethylidene)-1-pyridinyl]methyl]-2-thiophenyl]methyl]-4-pyridin-1-iumcarboxamide IUPAC Name: 1-[[5-[[(2E)-2-(nitrosomethylidene)pyridin-1-yl]methyl]thiophen-2-yl]methyl]pyridin-1-ium-4-carboxamide Traditional Name: 1-[[5-[[(2E)-2-(nitrosomethylene)-1-pyridyl]methyl]-2-thienyl]methyl]pyridin-1-ium-4-carboxamide Formula: C18H17N4O2S+ MolecularWeight: 353.41818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=O)N(C=C1)CC2=CC=C(S2)C[N+]3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=C/C(=C\N=O)/N(C=C1)CC2=CC=C(S2)C[N+]3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C18H16N4O2S/c19-18(23)14-6-9-21(10-7-14)12-16-4-5-17(25-16)13-22-8-2-1-3-15(22)11-20-24/h1-11H,12-13H2,(H-,19,23)/p+1/b15-11+