3-(4-butoxyphenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(4-butoxyphenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(4-butoxybenzoyl)-2-thioxo-quinazolin-4-olate CAS Name: 3-[(4-butoxyphenyl)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(4-butoxybenzoyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(4-butoxybenzoyl)-2-thioxo-quinazolin-4-olate Formula: C19H17N2O3S- MolecularWeight: 353.41488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2C(=C3C=CC=CC3=NC2=S)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2C(=C3C=CC=CC3=NC2=S)[O-]

InChI

InChI=1S/C19H18N2O3S/c1-2-3-12-24-14-10-8-13(9-11-14)17(22)21-18(23)15-6-4-5-7-16(15)20-19(21)25/h4-11,23H,2-3,12H2,1H3/p-1