3-(2-chloranyl-5-iodanyl-phenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(2-chloranyl-5-iodanyl-phenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(2-chloro-5-iodo-benzoyl)-2-thioxo-quinazolin-4-olate CAS Name: 3-[(2-chloro-5-iodophenyl)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(2-chloro-5-iodobenzoyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(2-chloro-5-iodo-benzoyl)-2-thioxo-quinazolin-4-olate Formula: C15H7ClIN2O2S- MolecularWeight: 441.65075

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(N(C(=S)N=C2C=C1)C(=O)C3=C(C=CC(=C3)I)Cl)[O-]

Isomeric SMILES

C1=CC2=C(N(C(=S)N=C2C=C1)C(=O)C3=C(C=CC(=C3)I)Cl)[O-]

InChI

InChI=1S/C15H8ClIN2O2S/c16-11-6-5-8(17)7-10(11)14(21)19-13(20)9-3-1-2-4-12(9)18-15(19)22/h1-7,20H/p-1