3-(4-butoxyphenyl)carbonyl-6,8-bis(chloranyl)-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(4-butoxyphenyl)carbonyl-6,8-bis(chloranyl)-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(4-butoxybenzoyl)-6,8-dichloro-2-thioxo-quinazolin-4-olate CAS Name: 3-[(4-butoxyphenyl)-oxomethyl]-6,8-dichloro-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(4-butoxybenzoyl)-6,8-dichloro-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(4-butoxybenzoyl)-6,8-dichloro-2-thioxo-quinazolin-4-olate Formula: C19H15Cl2N2O3S- MolecularWeight: 422.305

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2C(=C3C=C(C=C(C3=NC2=S)Cl)Cl)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2C(=C3C=C(C=C(C3=NC2=S)Cl)Cl)[O-]

InChI

InChI=1S/C19H16Cl2N2O3S/c1-2-3-8-26-13-6-4-11(5-7-13)17(24)23-18(25)14-9-12(20)10-15(21)16(14)22-19(23)27/h4-7,9-10,25H,2-3,8H2,1H3/p-1