6-iodanyl-2-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-olate

Systemtic Name: 6-iodanyl-2-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-olate Openeye Name: 6-iodo-2-[2-(2-methoxyanilino)-2-oxo-ethyl]sulfanyl-quinazolin-4-olate CAS Name: 6-iodo-2-[[2-(2-methoxyanilino)-2-oxoethyl]thio]-4-quinazolinolate IUPAC Name: 6-iodo-2-[2-(2-methoxyanilino)-2-oxoethyl]sulfanylquinazolin-4-olate Traditional Name: 6-iodo-2-[[2-keto-2-(o-anisidino)ethyl]thio]quinazolin-4-olate Formula: C17H13IN3O3S- MolecularWeight: 466.27289

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CSC2=NC3=C(C=C(C=C3)I)C(=N2)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CSC2=NC3=C(C=C(C=C3)I)C(=N2)[O-]

InChI

InChI=1S/C17H14IN3O3S/c1-24-14-5-3-2-4-13(14)19-15(22)9-25-17-20-12-7-6-10(18)8-11(12)16(23)21-17/h2-8H,9H2,1H3,(H,19,22)(H,20,21,23)/p-1