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

Systemtic Name: 3-butanoyl-6,8-bis(chloranyl)-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-butanoyl-6,8-dichloro-2-thioxo-quinazolin-4-olate CAS Name: 6,8-dichloro-3-(1-oxobutyl)-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-butanoyl-6,8-dichloro-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-butyryl-6,8-dichloro-2-thioxo-quinazolin-4-olate Formula: C12H9Cl2N2O2S- MolecularWeight: 316.18306

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(=C2C=C(C=C(C2=NC1=S)Cl)Cl)[O-]

Isomeric SMILES

CCCC(=O)N1C(=C2C=C(C=C(C2=NC1=S)Cl)Cl)[O-]

InChI

InChI=1S/C12H10Cl2N2O2S/c1-2-3-9(17)16-11(18)7-4-6(13)5-8(14)10(7)15-12(16)19/h4-5,18H,2-3H2,1H3/p-1