[3-(thiophen-2-ylmethyl)-8-oxa-2,4-diaza-5-azoniaspiro[4.5]deca-1,3-dien-1-yl]iminomethylideneazanide

Systemtic Name: [3-(thiophen-2-ylmethyl)-8-oxa-2,4-diaza-5-azoniaspiro[4.5]deca-1,3-dien-1-yl]iminomethylideneazanide Openeye Name: [3-(2-thienylmethyl)-8-oxa-2,4-diaza-5-azoniaspiro[4.5]deca-1,3-dien-1-yl]iminomethyleneazanide CAS Name: [3-(thiophen-2-ylmethyl)-8-oxa-2,4-diaza-5-azoniaspiro[4.5]deca-1,3-dien-1-yl]iminomethylideneazanide IUPAC Name: [3-(thiophen-2-ylmethyl)-8-oxa-2,4-diaza-5-azoniaspiro[4.5]deca-1,3-dien-1-yl]iminomethylideneazanide Traditional Name: [3-(2-thenyl)-8-oxa-2,4-diaza-5-azoniaspiro[4.5]deca-1,3-dien-1-yl]iminomethyleneazanide Formula: C12H13N5OS MolecularWeight: 275.32952

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]12C(=NC(=N2)CC3=CC=CS3)N=C=[N-]

Isomeric SMILES

C1COCC[N+]12C(=NC(=N2)CC3=CC=CS3)N=C=[N-]

InChI

InChI=1S/C12H13N5OS/c13-9-14-12-15-11(8-10-2-1-7-19-10)16-17(12)3-5-18-6-4-17/h1-2,7H,3-6,8H2