3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-6-iodanyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-6-iodanyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-6-iodo-2-thioxo-quinazolin-4-olate CAS Name: 3-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-6-iodo-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-6-iodo-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-6-iodo-2-thioxo-quinazolin-4-olate Formula: C17H10IN2O4S- MolecularWeight: 465.24177

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)N3C(=C4C=C(C=CC4=NC3=S)I)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)N3C(=C4C=C(C=CC4=NC3=S)I)[O-]

InChI

InChI=1S/C17H11IN2O4S/c18-10-2-3-12-11(8-10)16(22)20(17(25)19-12)15(21)9-1-4-13-14(7-9)24-6-5-23-13/h1-4,7-8,22H,5-6H2/p-1