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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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