6-bromanyl-3-(furan-2-ylmethyl)-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 6-bromanyl-3-(furan-2-ylmethyl)-2-sulfanylidene-quinazolin-4-olate Openeye Name: 6-bromo-3-(2-furylmethyl)-2-thioxo-quinazolin-4-olate CAS Name: 6-bromo-3-(2-furanylmethyl)-2-sulfanylidene-4-quinazolinolate IUPAC Name: 6-bromo-3-(furan-2-ylmethyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 6-bromo-3-(2-furfuryl)-2-thioxo-quinazolin-4-olate Formula: C13H8BrN2O2S- MolecularWeight: 336.18382

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=C3C=C(C=CC3=NC2=S)Br)[O-]

Isomeric SMILES

C1=COC(=C1)CN2C(=C3C=C(C=CC3=NC2=S)Br)[O-]

InChI

InChI=1S/C13H9BrN2O2S/c14-8-3-4-11-10(6-8)12(17)16(13(19)15-11)7-9-2-1-5-18-9/h1-6,17H,7H2/p-1