(Z)-2-diazonio-1-[4-ethoxycarbonyl-3-(1-ethyl-2-sulfanylidene-pyrrolidin-3-yl)-1H-pyrrol-2-yl]ethenolate

Systemtic Name: (Z)-2-diazonio-1-[4-ethoxycarbonyl-3-(1-ethyl-2-sulfanylidene-pyrrolidin-3-yl)-1H-pyrrol-2-yl]ethenolate Openeye Name: (Z)-2-diazonio-1-[4-ethoxycarbonyl-3-(1-ethyl-2-thioxo-pyrrolidin-3-yl)-1H-pyrrol-2-yl]ethenolate CAS Name: (Z)-2-diazonio-1-[4-ethoxycarbonyl-3-(1-ethyl-2-sulfanylidene-3-pyrrolidinyl)-1H-pyrrol-2-yl]ethenolate IUPAC Name: (Z)-2-diazonio-1-[4-ethoxycarbonyl-3-(1-ethyl-2-sulfanylidenepyrrolidin-3-yl)-1H-pyrrol-2-yl]ethenolate Traditional Name: (Z)-1-[4-carbethoxy-3-(1-ethyl-2-thioxo-pyrrolidin-3-yl)-1H-pyrrol-2-yl]-2-diazonio-ethenolate Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(C1=S)C2=C(NC=C2C(=O)OCC)C(=C[N+]#N)[O-]

Isomeric SMILES

CCN1CCC(C1=S)C2=C(NC=C2C(=O)OCC)/C(=C/[N+]#N)/[O-]

InChI

InChI=1S/C15H18N4O3S/c1-3-19-6-5-9(14(19)23)12-10(15(21)22-4-2)7-17-13(12)11(20)8-18-16/h7-9H,3-6H2,1-2H3,(H-,17,20,21)/b11-8-