(Z)-3-[3-(2,5-dimethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-4-oxidanylidene-pent-2-en-2-olate

Systemtic Name: (Z)-3-[3-(2,5-dimethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-4-oxidanylidene-pent-2-en-2-olate Openeye Name: (Z)-3-[3-(2,5-dimethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-4-oxo-pent-2-en-2-olate CAS Name: (Z)-3-[[3-(2,5-dimethoxyphenyl)-4-oxo-2-quinazolinyl]thio]-4-oxo-2-penten-2-olate IUPAC Name: (Z)-3-[3-(2,5-dimethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-4-oxopent-2-en-2-olate Traditional Name: (Z)-3-[[3-(2,5-dimethoxyphenyl)-4-keto-quinazolin-2-yl]thio]-4-keto-pent-2-en-2-olate Formula: C21H19N2O5S- MolecularWeight: 411.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C)SC1=NC2=CC=CC=C2C(=O)N1C3=C(C=CC(=C3)OC)OC)[O-]

Isomeric SMILES

C/C(=C(\C(=O)C)/SC1=NC2=CC=CC=C2C(=O)N1C3=C(C=CC(=C3)OC)OC)/[O-]

InChI

InChI=1S/C21H20N2O5S/c1-12(24)19(13(2)25)29-21-22-16-8-6-5-7-15(16)20(26)23(21)17-11-14(27-3)9-10-18(17)28-4/h5-11,24H,1-4H3/p-1/b19-12-