6,8-bis(chloranyl)-2-sulfanylidene-3-(3,4,5-triethoxyphenyl)carbonyl-1H-quinazolin-4-one

Systemtic Name: 6,8-bis(chloranyl)-2-sulfanylidene-3-(3,4,5-triethoxyphenyl)carbonyl-1H-quinazolin-4-one Openeye Name: 6,8-dichloro-2-thioxo-3-(3,4,5-triethoxybenzoyl)-1H-quinazolin-4-one CAS Name: 6,8-dichloro-3-[oxo-(3,4,5-triethoxyphenyl)methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6,8-dichloro-2-sulfanylidene-3-(3,4,5-triethoxybenzoyl)-1H-quinazolin-4-one Traditional Name: 6,8-dichloro-2-thioxo-3-(3,4,5-triethoxybenzoyl)-1H-quinazolin-4-one Formula: C21H20Cl2N2O5S MolecularWeight: 483.3649

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2C(=O)C3=CC(=CC(=C3NC2=S)Cl)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2C(=O)C3=CC(=CC(=C3NC2=S)Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O5S/c1-4-28-15-7-11(8-16(29-5-2)18(15)30-6-3)19(26)25-20(27)13-9-12(22)10-14(23)17(13)24-21(25)31/h7-10H,4-6H2,1-3H3,(H,24,31)