6-oxidanylidene-1-prop-2-enyl-5-[(1-propyl-1,2,3,4-tetrahydroquinolin-1-ium-6-yl)methylidene]-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: 6-oxidanylidene-1-prop-2-enyl-5-[(1-propyl-1,2,3,4-tetrahydroquinolin-1-ium-6-yl)methylidene]-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 1-allyl-6-oxo-5-[(1-propyl-1,2,3,4-tetrahydroquinolin-1-ium-6-yl)methylene]-2-thioxo-pyrimidin-4-olate CAS Name: 6-oxo-1-prop-2-enyl-5-[(1-propyl-1,2,3,4-tetrahydroquinolin-1-ium-6-yl)methylidene]-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 6-oxo-1-prop-2-enyl-5-[(1-propyl-1,2,3,4-tetrahydroquinolin-1-ium-6-yl)methylidene]-2-sulfanylidenepyrimidin-4-olate Traditional Name: 1-allyl-6-keto-5-[(1-propyl-1,2,3,4-tetrahydroquinolin-1-ium-6-yl)methylene]-2-thioxo-pyrimidin-4-olate Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCCC2=C1C=CC(=C2)C=C3C(=NC(=S)N(C3=O)CC=C)[O-]

Isomeric SMILES

CCC[NH+]1CCCC2=C1C=CC(=C2)C=C3C(=NC(=S)N(C3=O)CC=C)[O-]

InChI

InChI=1S/C20H23N3O2S/c1-3-9-22-11-5-6-15-12-14(7-8-17(15)22)13-16-18(24)21-20(26)23(10-4-2)19(16)25/h4,7-8,12-13H,2-3,5-6,9-11H2,1H3,(H,21,24,26)