2-[[6-bromanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[[6-bromanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[[6-bromo-3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[[6-bromo-3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[[6-bromo-3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[[6-bromo-3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]methyl]isoindoline-1,3-quinone Formula: C22H14BrN3O4S MolecularWeight: 496.33326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=NC4=C(C=C(C=C4)Br)C(=O)N3CC5=CC=CO5

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=NC4=C(C=C(C=C4)Br)C(=O)N3CC5=CC=CO5

InChI

InChI=1S/C22H14BrN3O4S/c23-13-7-8-18-17(10-13)21(29)25(11-14-4-3-9-30-14)22(24-18)31-12-26-19(27)15-5-1-2-6-16(15)20(26)28/h1-10H,11-12H2