6-iodanyl-3-propanoyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 6-iodanyl-3-propanoyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 6-iodo-3-propanoyl-2-thioxo-quinazolin-4-olate CAS Name: 6-iodo-3-(1-oxopropyl)-2-sulfanylidene-4-quinazolinolate IUPAC Name: 6-iodo-3-propanoyl-2-sulfanylidenequinazolin-4-olate Traditional Name: 6-iodo-3-propionyl-2-thioxo-quinazolin-4-olate Formula: C11H8IN2O2S- MolecularWeight: 359.16289

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(=C2C=C(C=CC2=NC1=S)I)[O-]

Isomeric SMILES

CCC(=O)N1C(=C2C=C(C=CC2=NC1=S)I)[O-]

InChI

InChI=1S/C11H9IN2O2S/c1-2-9(15)14-10(16)7-5-6(12)3-4-8(7)13-11(14)17/h3-5,16H,2H2,1H3/p-1