6-(3-methoxypropyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-olate

Systemtic Name: 6-(3-methoxypropyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-olate Openeye Name: 6-(3-methoxypropyl)-2-thioxo-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-olate CAS Name: 6-(3-methoxypropyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-olate IUPAC Name: 6-(3-methoxypropyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-olate Traditional Name: 6-(3-methoxypropyl)-2-thioxo-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-olate Formula: C11H17N3O2S MolecularWeight: 255.33658

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[NH+]1CCC2=C(C1)C(=NC(=S)N2)[O-]

Isomeric SMILES

COCCC[NH+]1CCC2=C(C1)C(=NC(=S)N2)[O-]

InChI

InChI=1S/C11H17N3O2S/c1-16-6-2-4-14-5-3-9-8(7-14)10(15)13-11(17)12-9/h2-7H2,1H3,(H2,12,13,15,17)