3-(2-ethoxyphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-ethoxyphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2-ethoxyphenyl)-2-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-ethoxyphenyl)-2-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-4-quinazolinone IUPAC Name: 3-(2-ethoxyphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanylquinazolin-4-one Traditional Name: 2-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]-3-o-phenetyl-quinazolin-4-one Formula: C22H17N3O5S MolecularWeight: 435.45248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC=CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2S/C=C/C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O5S/c1-2-29-19-10-6-5-9-18(19)24-21(26)16-7-3-4-8-17(16)23-22(24)31-14-13-15-11-12-20(30-15)25(27)28/h3-14H,2H2,1H3/b14-13+