5-(6-methyl-7-oxidanyl-1,3-dihydrofuro[3,4-c]pyridin-5-ium-1-yl)-6-oxidanylidene-3-phenyl-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: 5-(6-methyl-7-oxidanyl-1,3-dihydrofuro[3,4-c]pyridin-5-ium-1-yl)-6-oxidanylidene-3-phenyl-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-5-ium-1-yl)-6-oxo-3-phenyl-2-thioxo-pyrimidin-4-olate CAS Name: 5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-5-ium-1-yl)-6-oxo-3-phenyl-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-5-ium-1-yl)-6-oxo-3-phenyl-2-sulfanylidenepyrimidin-4-olate Traditional Name: 5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-5-ium-1-yl)-6-keto-3-phenyl-2-thioxo-pyrimidin-4-olate Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C=C2COC(C2=C1O)C3=C(N(C(=S)NC3=O)C4=CC=CC=C4)[O-]

Isomeric SMILES

CC1=[NH+]C=C2COC(C2=C1O)C3=C(N(C(=S)NC3=O)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C18H15N3O4S/c1-9-14(22)12-10(7-19-9)8-25-15(12)13-16(23)20-18(26)21(17(13)24)11-5-3-2-4-6-11/h2-7,15,22,24H,8H2,1H3,(H,20,23,26)