[1,5-bis(oxidanylidene)-3-sulfanylidene-4H-chromeno[3,4-d]pyrimidin-9-yl] benzoate

Systemtic Name: [1,5-bis(oxidanylidene)-3-sulfanylidene-4H-chromeno[3,4-d]pyrimidin-9-yl] benzoate Openeye Name: (1,5-dioxo-3-thioxo-4H-chromeno[3,4-d]pyrimidin-9-yl) benzoate CAS Name: benzoic acid (1,5-dioxo-3-sulfanylidene-4H-[1]benzopyrano[3,4-d]pyrimidin-9-yl) ester IUPAC Name: (1,5-dioxo-3-sulfanylidene-4H-chromeno[3,4-d]pyrimidin-9-yl) benzoate Traditional Name: benzoic acid (1,5-diketo-3-thioxo-4H-chromeno[3,4-d]pyrimidin-9-yl) ester Formula: C18H10N2O5S MolecularWeight: 366.3474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)OC(=O)C4=C3C(=O)NC(=S)N4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)OC(=O)C4=C3C(=O)NC(=S)N4

InChI

InChI=1S/C18H10N2O5S/c21-15-13-11-8-10(24-16(22)9-4-2-1-3-5-9)6-7-12(11)25-17(23)14(13)19-18(26)20-15/h1-8H,(H2,19,20,21,26)