3-(3-butoxyphenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(3-butoxyphenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(3-butoxybenzoyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(3-butoxyphenyl)-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(3-butoxybenzoyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(3-butoxybenzoyl)-2-thioxo-1H-quinazolin-4-one Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)N2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)N2C(=O)C3=CC=CC=C3NC2=S

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/h4-10,12H,2-3,11H2,1H3,(H,20,25)