2-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-3-butyl-quinazolin-4-one

Systemtic Name: 2-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-3-butyl-quinazolin-4-one Openeye Name: 3-butyl-2-[2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-butyl-2-[[2-(3,4-dihydroxyphenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-butyl-2-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-butyl-2-[[2-(3,4-dihydroxyphenyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C20H20N2O4S/c1-2-3-10-22-19(26)14-6-4-5-7-15(14)21-20(22)27-12-18(25)13-8-9-16(23)17(24)11-13/h4-9,11,23-24H,2-3,10,12H2,1H3