6-iodanyl-3-[5-(2-nitrophenyl)furan-2-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-iodanyl-3-[5-(2-nitrophenyl)furan-2-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-iodo-3-[5-(2-nitrophenyl)furan-2-carbonyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 6-iodo-3-[[5-(2-nitrophenyl)-2-furanyl]-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-iodo-3-[5-(2-nitrophenyl)furan-2-carbonyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-iodo-3-[5-(2-nitrophenyl)-2-furoyl]-2-thioxo-1H-quinazolin-4-one Formula: C19H10IN3O5S MolecularWeight: 519.26927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(O2)C(=O)N3C(=O)C4=C(C=CC(=C4)I)NC3=S)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(O2)C(=O)N3C(=O)C4=C(C=CC(=C4)I)NC3=S)[N+](=O)[O-]

InChI

InChI=1S/C19H10IN3O5S/c20-10-5-6-13-12(9-10)17(24)22(19(29)21-13)18(25)16-8-7-15(28-16)11-3-1-2-4-14(11)23(26)27/h1-9H,(H,21,29)